Chem
J-GLOBAL ID：200907088314982503
Nikkaji number：J2.585.864F
3-Amino-6-nitro-1,2-benzoisothiazole
6-ニトロ-1,2-ベンゾチアゾール-3-アミン
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： C7H5N2[N+]O[O-]S
Molecular formula furigana： C7-H5-N3-O2-S
Molecular weight： 195.200
InChI：
InChI=1S/C7H5N3O2S/c8-7-5-2-1-4(10(11)12)3-6(5)13-9-7/h1-3H,(H2,8,9)
InChI key：
PLHOLGSXQBLUTF-UHFFFAOYSA-N
SMILES：
Nc1nsc2cc(ccc12)[N+](=O)[O-]
Systematic name (3)：
- 3-アミノ-6-ニトロ-1,2-ベンゾイソチアゾール
- 6-ニトロ-1,2-ベンゾチアゾール-3-アミン
- 6-nitro-1,2-benzothiazol-3-amine
- 3-Amino-6-nitro-1,2-benzoisothiazole
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