Molecule FYI-1003230

A

Molecule Summary:

ID: FYI-1003230
Names:
InChIKey: WUBVXTOLZKVNEG-UHFFFAOYSA-N
SMILES: COc4cc(NC(C(=O)N2CCc1ccc(OC(F)(F)F)cc12)c3ccc(Cl)cc3)cc(OCCCC(=O)O)c4

Received at FYIcenter.com on: 2023-05-25

Molecule ID: FYI-1003230 Edit

Molecule Structure InChIKey: WUBVXTOLZKVNEG-UHFFFAOYSA-N

Molecule Structure SMILES String: COc4cc(NC(C(=O)N2CCc1ccc(OC(F)(F)F)cc12)c3ccc(Cl)cc3)cc(OCCCC(=O)O)c4

Download SDF Download SVG Structure in 2D SDF:

FYI-1003230
FYIcenter.com

 40 43  0  0  0  0  0  0  0  0999 V2000
   14.7395    7.9834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.3147    7.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1022    8.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8898    7.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6773    8.6834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4649    7.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2525    8.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0400    7.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.5271   10.0834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  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  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12  9  2  0  0  0  0
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 37 24  1  0  0  0  0
 38 23  2  0  0  0  0
 39 13  2  0  0  0  0
 39  7  1  0  0  0  0
 40  2  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003230-3D
FYIcenter.com

 66 69  0     1  0  0  0  0  0999 V2000
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M  END
$$$$

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2023-06-12, 1524👍, 0💬