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Chem
J-GLOBAL ID：200907090110640640
Nikkaji number：J394.229E 2,4,6-Trihydroxy-3-nitro-N-(3-fluorophenyl)benzamide
2,4,6-トリヒドロキシ-3-ニトロ-N-(3-フルオロフェニル)ベンズアミド
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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： C13H9FN[N+]O5[O-]
Molecular formula furigana： C13-H9-F-N2-O6
Molecular weight： 308.221
InChI：
InChI=1S/C13H9FN2O6/c14-6-2-1-3-7(4-6)15-13(20)10-8(17)5-9(18)11(12(10)19)16(21)22/h1-5,17-19H,(H,15,20)
InChI key：
WMYFOHKUVNBHJD-UHFFFAOYSA-N
SMILES：
Oc1cc(O)c(c(O)c1C(=O)Nc1cccc(F)c1)[N+](=O)[O-]
Systematic name (3)： - 2,4,6-トリヒドロキシ-3-ニトロ-N-(3-フルオロフェニル)ベンズアミド
- N-(3-フルオロフェニル)-2,4,6-トリヒドロキシ-3-ニトロベンズアミド
- N-(3-fluorophenyl)-2,4,6-trihydroxy-3-nitrobenzamide
- 2,4,6-Trihydroxy-3-nitro-N-(3-fluorophenyl)benzamide
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