Molecule Editor

Molecule ID: FYI-1015940 Edit

Molecule Structure InChIKey: JQKZGXNUQMAFJL-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCCN

Download SDF Download SVG Structure in 2D SDF:

FYI-1015940
FYIcenter.com

 27 26  0  0  0  0  0  0  0  0999 V2000
   13.3369    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0985    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16  1  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015940-3D
FYIcenter.com

 72 71  0  0  0  0  0  0  0  0999 V2000
    4.7343   -2.5646   -3.6656 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9509   -1.7181   -2.4218 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5171   -2.5562   -1.2763 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7334   -1.7120   -0.0212 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2990   -2.5523    1.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5033   -1.7004    2.3752 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0895   -2.4598    3.4610 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4548   -2.5836    3.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2398   -2.0708    2.7837 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8959   -3.4048    4.7729 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4199   -3.4494    4.8422 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9358   -4.2663    6.0197 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4663   -4.2704    6.0272 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0127   -5.0822    7.1954 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5423   -5.0865    7.2016 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0561   -5.9047    8.3799 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5803   -5.9515    8.4511 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0141   -6.7789    9.6461 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2291   -7.3500   10.3944 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3799   -6.8387    9.8065 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9737   -7.6259   10.8702 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1728   -9.0926   10.4893 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1569   -9.2571    9.3300 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3742  -10.7293    8.9826 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3531  -10.8780    7.8152 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5667  -12.3483    7.4641 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5067  -12.4872    6.3543 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3284   -1.9527   -4.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0290   -3.3779   -3.4666 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6766   -3.0037   -4.0085 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9976   -1.2682   -2.1205 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6369   -0.8964   -2.6590 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4689   -3.0048   -1.5860 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8296   -3.3802   -1.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5621   -5.2946    5.9530 H   0  0  0  0  0  0  0  0  0  0  0  0
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   12.8378   -3.2403    6.0909 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8379   -4.6895    5.0840 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6416   -6.1124    7.1317 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6414   -4.6636    8.1389 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9175   -4.0585    7.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9174   -5.5100    6.2624 H   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9885   -4.9394    8.5508 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9901   -6.4035    7.5402 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.9815   -6.3947    9.1256 H   0  0  0  0  0  0  0  0  0  0  0  0
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   19.5527   -9.6316   11.3661 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1159   -8.7972    9.5974 H   0  0  0  0  0  0  0  0  0  0  0  0
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   20.7606  -11.2631    9.8595 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.3115  -10.4143    8.0808 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  2  3  1  0  0  0  0
  2 31  1  0  0  0  0
  2 32  1  0  0  0  0
  3  4  1  0  0  0  0
  3 33  1  0  0  0  0
  3 34  1  0  0  0  0
  4  5  1  0  0  0  0
  4 35  1  0  0  0  0
  4 36  1  0  0  0  0
  5  6  1  0  0  0  0
  5 37  1  0  0  0  0
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  6  7  1  0  0  0  0
  6 39  1  0  0  0  0
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  7 41  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
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 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
 13 48  1  0  0  0  0
 13 49  1  0  0  0  0
 14 15  1  0  0  0  0
 14 50  1  0  0  0  0
 14 51  1  0  0  0  0
 15 16  1  0  0  0  0
 15 52  1  0  0  0  0
 15 53  1  0  0  0  0
 16 17  1  0  0  0  0
 16 54  1  0  0  0  0
 16 55  1  0  0  0  0
 17 18  1  0  0  0  0
 17 56  1  0  0  0  0
 17 57  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 58  1  0  0  0  0
 21 22  1  0  0  0  0
 21 59  1  0  0  0  0
 21 60  1  0  0  0  0
 22 23  1  0  0  0  0
 22 61  1  0  0  0  0
 22 62  1  0  0  0  0
 23 24  1  0  0  0  0
 23 63  1  0  0  0  0
 23 64  1  0  0  0  0
 24 25  1  0  0  0  0
 24 65  1  0  0  0  0
 24 66  1  0  0  0  0
 25 26  1  0  0  0  0
 25 67  1  0  0  0  0
 25 68  1  0  0  0  0
 26 27  1  0  0  0  0
 26 69  1  0  0  0  0
 26 70  1  0  0  0  0
 27 71  1  0  0  0  0
 27 72  1  0  0  0  0
M  END
$$$$