Molecule FYI-1016127

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Molecule Summary:

ID: FYI-1016127
Names:
InChIKey: QUXFCHDFRTXVLH-UHFFFAOYSA-N
SMILES: O=C1CCCCC(=O)NCCOCCCCCCN1

Received at FYIcenter.com on: 2025-11-24

Molecule ID: FYI-1016127 Edit

Molecule Structure InChIKey: QUXFCHDFRTXVLH-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCC(=O)NCCOCCCCCCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016127
FYIcenter.com

 19 19  0  0  0  0  0  0  0  0999 V2000
    1.2210    1.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4334    2.0898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    1.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0525    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0748    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8753    2.0596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8086    1.0160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0048    1.7432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9823    3.1430    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2239    1.0548    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3832    1.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4194    0.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6593    1.5484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9491    1.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3490    0.9942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6756    0.5469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5659    3.3553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8759    3.8490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7190    4.9668    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 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
  5 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 16 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016127-3D
FYIcenter.com

 45 45  0  0  0  0  0  0  0  0999 V2000
    1.0764   -0.0082    0.2271 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2992   -0.0113    0.0849 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1297   -1.2874    0.0768 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4233   -2.3940    0.8763 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3846   -3.2758    1.6902 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8217   -3.6415    3.0796 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6910   -3.0823    4.1954 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9022   -2.9136    4.0798 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0066   -2.7557    5.3505 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5986   -1.8003    6.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5265   -0.3961    5.6811 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8401    0.6432    6.6016 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8195    1.9770    6.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0785    2.1372    4.7178 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1140    3.5371    4.1035 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4306    3.5285    2.7210 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3081    2.8831    1.6386 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5275    2.4276    0.4007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0434    1.1413   -0.0442 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1072   -1.0531    0.5188 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2927   -1.5975   -0.9567 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8619   -3.0297    0.1784 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6792   -1.9510    1.5461 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3575   -2.7822    1.7792 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5678   -4.2003    1.1291 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7944   -4.7300    3.1985 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7958   -3.2762    3.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9975   -2.8274    5.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6392   -2.0738    6.4922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0435   -1.8529    7.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4938   -0.2509    5.3435 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1988   -0.3495    4.8170 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8578    2.3138    5.9538 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3485    2.6114    6.8094 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0326    1.8367    4.8538 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5069    1.4396    3.9955 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1463    3.8936    4.0102 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5842    4.2321    4.7647 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1980    4.5570    2.4229 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4738    2.9975    2.8041 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8534    2.0292    2.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0809    3.5991    1.3316 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6583    3.1369   -0.4206 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4563    2.3421    0.6123 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0345    1.0647   -0.2285 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 19  1  0  0  0  0
  3  4  1  0  0  0  0
  3 20  1  0  0  0  0
  3 21  1  0  0  0  0
  4  5  1  0  0  0  0
  4 22  1  0  0  0  0
  4 23  1  0  0  0  0
  5  6  1  0  0  0  0
  5 24  1  0  0  0  0
  5 25  1  0  0  0  0
  6  7  1  0  0  0  0
  6 26  1  0  0  0  0
  6 27  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 28  1  0  0  0  0
 10 11  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 11 12  1  0  0  0  0
 11 31  1  0  0  0  0
 11 32  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 15  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 16  1  0  0  0  0
 15 37  1  0  0  0  0
 15 38  1  0  0  0  0
 16 17  1  0  0  0  0
 16 39  1  0  0  0  0
 16 40  1  0  0  0  0
 17 18  1  0  0  0  0
 17 41  1  0  0  0  0
 17 42  1  0  0  0  0
 18 19  1  0  0  0  0
 18 43  1  0  0  0  0
 18 44  1  0  0  0  0
 19 45  1  0  0  0  0
M  END
$$$$

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