Molecule Editor

Molecule ID: FYI-1016315 Edit

Molecule Structure InChIKey: BVGSDVLCVTUIFC-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCCCCNC(=O)CCCCCCCNC(=O)CCCCCNC(=O)CCCCCCCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016315
FYIcenter.com

 38 38  0  0  0  0  0  0  0  0999 V2000
   16.2583   12.6572    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0459   11.9572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2370   13.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2319   14.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0649   14.8478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7756   15.3935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4081   15.6930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0087   15.7361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6253   15.5213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3049   15.0561    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0925   14.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2836   15.4988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.3262    0.8065    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6466    1.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2318    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8591    1.9719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9223    2.8827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7999    3.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4623    5.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8866    6.5409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0587    7.9303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9726    9.3276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6311   10.6853    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  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  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
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 13 11  1  0  0  0  0
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 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
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 27 26  1  0  0  0  0
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 37 36  1  0  0  0  0
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 38  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016315-3D
FYIcenter.com

 94 94  0  0  0  0  0  0  0  0999 V2000
    2.3888   10.4447    4.0184 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2852   17.1006    7.3320 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3259   18.3260    7.9389 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7110   17.6277    7.7397 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5380   11.0449    6.5096 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0168    9.7944    6.3747 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8824    9.5885    6.8119 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$