Molecule Editor

Molecule ID: FYI-1016128 Edit

Molecule Structure InChIKey: LYZDYSAWXZICRB-UHFFFAOYSA-N

Molecule Structure SMILES String: NCCCCCCNC(=O)CCCCCCC(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016128
FYIcenter.com

 19 18  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.3706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393    2.0218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2349    3.4218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1949    0.9986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3798    1.7442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6854    1.2388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9620    1.8136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3196    1.4719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4648    2.2772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5536    1.3971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4639    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6946    2.2084    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8892    1.4783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2286    1.8857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5317    1.3737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3438    2.5141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3732    1.5653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2705    2.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2820    1.6721    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016128-3D
FYIcenter.com

 47 46  0  0  0  0  0  0  0  0999 V2000
    0.7683    5.0555    2.7337 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2233    5.1304    2.7749 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8076    3.7907    3.2166 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3348    3.8494    3.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9264    2.5107    3.7025 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4537    2.5662    3.7508 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0339    1.2228    4.1849 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4806    1.2610    4.2737 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1056    1.6203    5.4467 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4889    1.9659    6.4505 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6220    1.5841    5.3893 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1875    1.2745    6.7767 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7131    1.2452    6.7989 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2346    0.9193    8.2041 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7614    0.8925    8.2239 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3295    0.5698    9.6070 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8420    0.5558    9.5740 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5276    0.7682    8.5865 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3902    0.2716   10.7782 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3909    5.9677    2.4809 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4107    4.8476    3.6655 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5280    5.9237    3.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5968    5.3936    1.7795 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4929    3.0007    2.5227 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4204    3.5225    4.2079 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6502    4.6360    3.9605 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7242    4.1177    2.2749 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6086    1.7234    3.0083 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5368    2.2444    4.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7724    3.3544    4.4438 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8491    2.8364    2.7640 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7705    0.4384    3.4688 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6256    0.9375    5.1614 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0288    1.0295    3.4552 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9678    2.5646    5.0425 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9560    0.8304    4.6673 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7974    0.3055    7.1135 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8328    2.0223    7.4967 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1042    2.2181    6.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0794    0.4963    6.0866 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8428   -0.0532    8.5264 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8682    1.6682    8.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1455    1.8651    7.8917 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1202    0.1487    7.5015 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9790   -0.4153    9.9344 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0047    1.3254   10.3306 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7328    0.1212   11.4862 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  1  0  0  0  0
  2 22  1  0  0  0  0
  2 23  1  0  0  0  0
  3  4  1  0  0  0  0
  3 24  1  0  0  0  0
  3 25  1  0  0  0  0
  4  5  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  5  6  1  0  0  0  0
  5 28  1  0  0  0  0
  5 29  1  0  0  0  0
  6  7  1  0  0  0  0
  6 30  1  0  0  0  0
  6 31  1  0  0  0  0
  7  8  1  0  0  0  0
  7 32  1  0  0  0  0
  7 33  1  0  0  0  0
  8  9  1  0  0  0  0
  8 34  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 35  1  0  0  0  0
 11 36  1  0  0  0  0
 12 13  1  0  0  0  0
 12 37  1  0  0  0  0
 12 38  1  0  0  0  0
 13 14  1  0  0  0  0
 13 39  1  0  0  0  0
 13 40  1  0  0  0  0
 14 15  1  0  0  0  0
 14 41  1  0  0  0  0
 14 42  1  0  0  0  0
 15 16  1  0  0  0  0
 15 43  1  0  0  0  0
 15 44  1  0  0  0  0
 16 17  1  0  0  0  0
 16 45  1  0  0  0  0
 16 46  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 47  1  0  0  0  0
M  END
$$$$