Chem
J-GLOBAL ID：200907031464563124
Nikkaji number：J635.899C
4-Nitrobenzenecarbonitrile oxide
4-ニトロベンゾニトリルオキシド
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C7H4[N+]2O[O-]2
Molecular formula furigana： C7-H4-N2-O3
Molecular weight： 164.120
InChI：
InChI=1S/C7H4N2O3/c10-8-5-6-1-3-7(4-2-6)9(11)12/h1-4H
InChI key：
OFALIKGBMGHLIH-UHFFFAOYSA-N
SMILES：
[O-][N+]#Cc1ccc(cc1)[N+](=O)[O-]
Systematic name (4)：
- 4-ニトロベンゾニトリルオキシド
- 4-ニトロベンゼンカルボニトリルオキシド
- (4-ニトロフェニル)ホルモニトリル オキシド
- (4-nitrophenyl)formonitrile oxide
- 4-Nitrobenzonitrileoxide
- 4-Nitrobenzenecarbonitrile oxide
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