Molecule FYI-1004270

A

Molecule Summary:

ID: FYI-1004270
Names:
InChIKey: WORLSQOIFHQYBK-UHFFFAOYSA-N
SMILES: CCc1ccccc1N(CC(=O)NC2CCCCC2)C(=O)Cc3ccc(C(=O)NO)cc3F

Received at FYIcenter.com on: 2023-08-24

Molecule ID: FYI-1004270 Edit

Molecule Structure InChIKey: WORLSQOIFHQYBK-UHFFFAOYSA-N

Molecule Structure SMILES String: CCc1ccccc1N(CC(=O)NC2CCCCC2)C(=O)Cc3ccc(C(=O)NO)cc3F

Download SDF Download SVG Structure in 2D SDF:

FYI-1004270
FYIcenter.com

 33 35  0  0  0  0  0  0  0  0999 V2000
    8.4871    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6996    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.8000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    2.1000    0.0000 C   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
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  6  5  1  0  0  0  0
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  9  8  1  0  0  0  0
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 11 10  1  0  0  0  0
 12  9  2  0  0  0  0
 13  8  1  0  0  0  0
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 17 16  1  0  0  0  0
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 31 26  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004270-3D
FYIcenter.com

 63 65  0  0  0  0  0  0  0  0999 V2000
    0.7783   -3.6709    3.4720 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5267   -2.6709    2.3467 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8193   -0.6615    2.9746 C   0  0  0  0  0  0  0  0  0  0  0  0
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 32 33  1  0  0  0  0
M  END
$$$$

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2023-09-07, 917👍, 0💬