Chem
J-GLOBAL ID：200907067841207707   Nikkaji number：J1.352.183B

3-[[(1R)-2β-Acetoxycyclohexane-1β-yl]oxy]-2H-1,5-benzodithiepin 1,5-dioxide

3-[[(1R)-2β-アセトキシシクロヘキサン-1β-イル]オキシ]-2H-1,5-ベンゾジチエピン1,5-ジオキシド
Substance type：
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
Molecular formula： C17H20O3[O-]2[S+]2
Molecular formula furigana： C17-H20-O5-S2
Molecular weight： 368.460
InChI： InChI=1S/C17H20O5S2/c1-12(18)21-14-6-2-3-7-15(14)22-13-10-23(19)16-8-4-5-9-17(16)24(20)11-13/h4-5,8-10,14-15H,2-3,6-7,11H2,1H3/t14-,15+,23?,24?/m0/s1
InChI key： ZJPMHVRLPZXHLU-ZIJBHRIASA-N
SMILES： CC(=O)O[C@H]1CCCC[C@H]1OC1=C[S+]([O-])c2ccccc2[S+]([O-])C1
Systematic name  (3)：
  • 3-[[(1R)-2β-アセトキシシクロヘキサン-1β-イル]オキシ]-2H-1,5-ベンゾジチエピン1,5-ジオキシド
  • 3-{[(1R,2S)-2-(アセチルオキシ)シクロヘキシル]オキシ}-4,5-ジヒドロ-1H-1,5-ベンゾジチエピン-1,5-ジイウム-1,5-ビス(オラート)
  • 3-{[(1R,2S)-2-(acetyloxy)cyclohexyl]oxy}-4,5-dihydro-1H-1,5-benzodithiepine-1,5-diium-1,5-bis(olate)
Other name (1)：
  • 3-[[(1R)-2β-Acetoxycyclohexane-1β-yl]oxy]-2H-1,5-benzodithiepin 1,5-dioxide
Thsaurus map：
Thesaurus Map

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