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Chem
J-GLOBAL ID：200907048687074370
Nikkaji number：J444.439F 3-[(4-Methylphenyl)sulfonyl]-3H-1,2,3-benzoxathiazole 2,2-dioxide
3-[(4-メチルフェニル)スルホニル]-3H-1,2,3-ベンゾオキサチアゾール2,2-ジオキシド
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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： C13H11NO3[O-]2S[S+2]
Molecular formula furigana： C13-H11-N-O5-S2
Molecular weight： 325.350
InChI：
InChI=1S/C13H11NO5S2/c1-10-6-8-11(9-7-10)20(15,16)14-12-4-2-3-5-13(12)19-21(14,17)18/h2-9H,1H3
InChI key：
YIKRJKUIYMUUTP-UHFFFAOYSA-N
SMILES：
Cc1ccc(cc1)S(=O)(=O)N1c2ccccc2O[S+2]1([O-])[O-]
Systematic name (3)： - 3-[(4-メチルフェニル)スルホニル]-3H-1,2,3-ベンゾオキサチアゾール2,2-ジオキシド
- 3-(4-メチルベンゼンスルホニル)-2,3-ジヒドロ-1,2,3-ベンゾオキサチアゾール-2,2-ジイウム-2,2-ビス(オラート)
- 3-(4-methylbenzenesulfonyl)-2,3-dihydro-1,2,3-benzoxathiazole-2,2-diium-2,2-bis(olate)
- 3-[(4-Methylphenyl)sulfonyl]-3H-1,2,3-benzoxathiazole 2,2-dioxide
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