Molecule FYI-1005641

A

Molecule Summary:

ID: FYI-1005641
Names:
InChIKey: NBJIVSJKAORMPB-UHFFFAOYSA-N
SMILES: COc7ccc(C(=O)C5C2c1ccccc1C=CN2C(C(=O)c3ccc(OC)c(OC)c3)C6c4ccccc4C=CN56)cc7OC

Received at FYIcenter.com on: 2023-11-08

Molecule ID: FYI-1005641 Edit

Molecule Structure InChIKey: NBJIVSJKAORMPB-UHFFFAOYSA-N

Molecule Structure SMILES String: COc7ccc(C(=O)C5C2c1ccccc1C=CN2C(C(=O)c3ccc(OC)c(OC)c3)C6c4ccccc4C=CN56)cc7OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1005641
FYIcenter.com

 46 52  0  0  0  0  0  0  0  0999 V2000
   12.1244   12.5999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9118   13.2999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994   12.5999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   13.2999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745   12.5999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9118   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   11.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0621    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  8  3  1  0  0  0  0
  9  8  1  0  0  0  0
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 37 35  1  0  0  0  0
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 39 38  1  0  0  0  0
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 42 39  2  0  0  0  0
 43 42  1  0  0  0  0
 44 43  1  0  0  0  0
 45 42  1  0  0  0  0
 46 45  2  0  0  0  0
 46 37  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005641-3D
FYIcenter.com

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M  END
$$$$

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2023-11-13, 2324👍, 0💬