Molecule Editor

Molecule ID: FYI-1016134 Edit

Molecule Structure InChIKey: AVFMSQAMZZRAJJ-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCCCCCCCCNC(=O)CCCCCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016134
FYIcenter.com

 22 22  0  0  0  0  0  0  0  0999 V2000
    0.8849    1.6356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7524    1.0454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0542    2.9254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4631    5.8885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0141    2.3387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4277    3.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5600    4.8335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5430    7.1611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3105    7.6321    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6283    7.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7927    8.5069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3186    9.7170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4775   10.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5866   11.6628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6893    0.0051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8212    0.0000    0.0000 N   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
  3  4  1  0  0  0  0
  1  6  1  0  0  0  0
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 14 15  1  0  0  0  0
  9 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
 19 20  2  0  0  0  0
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  5 21  2  0  0  0  0
  5 22  1  0  0  0  0
  4 22  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016134-3D
FYIcenter.com

 56 56  0     0  0  0  0  0  0999 V2000
    2.9723   -0.5807   -1.8904 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5124   -2.0186    0.9925 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2893   -1.0817   -1.1224 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7072   -1.2519    0.2091 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7757    2.1160    1.2003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0280    2.9975    1.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4313    2.7370    0.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6292    3.2099   -0.2504 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6787    1.8615    0.6512 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$