Molecule FYI-1002196

A

Molecule Summary:

ID: FYI-1002196
Names:
InChIKey: WYIIEETUMNWGTC-SREFSNCVSA-N
SMILES: O=C2c1ccccc1C(=O)C26C(c3ccccc3)C(N(=O)=O)C(c4ccc(Br)cc4)C5CCCCC56O

Received at FYIcenter.com on: 2023-02-05

Molecule ID: FYI-1002196 Edit

Molecule Structure InChIKey: WYIIEETUMNWGTC-SREFSNCVSA-N

Molecule Structure SMILES String: O=C2c1ccccc1C(=O)C26C(c3ccccc3)C(N(=O)=O)C(c4ccc(Br)cc4)C5CCCCC56O

Download SDF Download SVG Structure in 2D SDF:

FYI-1002196
FYIcenter.com

 38 43  0  0  0  0  0  0  0  0999 V2000
    6.7406    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3157    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7406    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1033    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.7406    1.4000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5903    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
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  7 12  1  0  0  0  0
  7  8  1  0  0  0  0
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  8 26  1  0  0  0  0
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 24 32  2  0  0  0  0
  9 36  1  0  0  0  0
 10 37  1  1  0  0  0
 20 38  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002196-3D
FYIcenter.com

 63 68  0  0  1  0  0  0  0  0999 V2000
    1.0246    0.6168    0.6212 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9225    2.7665    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-02-28, 493👍, 0💬