Molecule FYI-1014346

A

Molecule Summary:

ID: FYI-1014346
Names:
InChIKey: WGMPGOIMDPTOAX-ZNVPEIAMSA-N
SMILES: O=N(=O)c4ccc(N/N=C/c1ccccc1)c([N+](=O)O[Zn]O[N+](=O)c3ccc(N/N=C/c2ccccc2)c(N(=O)=O)c3)c4

Received at FYIcenter.com on: 2025-04-03

Molecule ID: FYI-1014346 Edit

Molecule Structure InChIKey: WGMPGOIMDPTOAX-ZNVPEIAMSA-N

Molecule Structure SMILES String: O=N(=O)c4ccc(N/N=C/c1ccccc1)c([N+](=O)O[Zn]O[N+](=O)c3ccc(N/N=C/c2ccccc2)c(N(=O)=O)c3)c4

Download SDF Download SVG Structure in 2D SDF:

FYI-1014346
FYIcenter.com

 43 46  0  0  0  0  0  0  0  0999 V2000
   18.1865    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9740    9.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9740   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    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
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5492    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
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 23 22  1  0  0  0  0
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 40 39  2  0  0  0  0
 40 26  1  0  0  0  0
 41 28  1  0  0  0  0
 42 41  2  0  0  0  0
 43 41  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014346-3D
FYIcenter.com

 63 66  0  0  0  0  0  0  0  0999 V2000
    1.4835    1.2742   -0.1994 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5579    0.7504   -0.1935 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1836    0.7251    0.8256 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0868    0.1717   -1.3888 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3544    0.1843   -2.5874 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8724   -0.3957   -3.7489 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1532   -0.9749   -3.7597 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6316   -1.6074   -4.9514 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7751   -2.1244   -5.8996 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2604   -2.7714   -6.9065 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4215   -3.5164   -7.8629 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3041   -4.9449   -9.8267 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0531   -1.4013   -3.5023 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7808   -2.1422   -3.4767 Zn  0  0  0  0  0  0  0  0  0  0  0  0
   10.5085   -2.8831   -3.4510 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 10 47  1  0  0  0  0
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 43 63  1  0  0  0  0
M  END
$$$$

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2025-04-26, 956👍, 0💬