Molecule FYI-1002076

A

Molecule Summary:

ID: FYI-1002076
Names:
InChIKey: CTBRLZHCTSRPOR-ZTDHTWSHSA-N
SMILES: CC3N(CCCCCCC(=O)Nc1ccccc1)c2ccccc2[C@@]34CCN(C)C4

Received at FYIcenter.com on: 2023-01-25

Molecule ID: FYI-1002076 Edit

Molecule Structure InChIKey: CTBRLZHCTSRPOR-ZTDHTWSHSA-N

Molecule Structure SMILES String: CC3N(CCCCCCC(=O)Nc1ccccc1)c2ccccc2[C@@]34CCN(C)C4

Download SDF Download SVG Structure in 2D SDF:

FYI-1002076
FYIcenter.com

 30 33  0  0  1  0  0  0  0  0999 V2000
   12.4426    5.1291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4831    4.1923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    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
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    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
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   16.2219    4.7744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3682    6.1668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0892    6.7362    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7981    8.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1525    5.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  4  3  1  0  0  0  0
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  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
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 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 18 13  1  0  0  0  0
 19  3  1  0  0  0  0
 20 19  2  0  0  0  0
 21 20  1  0  0  0  0
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 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
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 25  2  1  6  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 28  1  0  0  0  0
 30 25  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002076-3D
FYIcenter.com

 65 68  0  0  1  0  0  0  0  0999 V2000
    2.0465   -0.9084   -3.2553 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-02-04, 2256👍, 0💬