Chem
J-GLOBAL ID:200907000785552806   Nikkaji number:J1.423.727E

Benzenesulfonic acid 2,3-bis(methylthio)-4-hydroxy-5,8-dihydro-5,8-methanonaphthalene-1-yl ester

ベンゼンスルホン酸2,3-ビス(メチルチオ)-4-ヒドロキシ-5,8-ジヒドロ-5,8-メタノナフタレン-1-イル
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: C19H18O4S3
Molecular formula furigana: C19-H18-O4-S3
Molecular weight: 406.530
InChI: InChI=1S/C19H18O4S3/c1-24-18-16(20)14-11-8-9-12(10-11)15(14)17(19(18)25-2)23-26(21,22)13-6-4-3-5-7-13/h3-9,11-12,20H,10H2,1-2H3
InChI key: AKBABTSBSBLPSN-UHFFFAOYSA-N
SMILES: CSc1c(O)c2C3CC(C=C3)c2c(OS(=O)(=O)c2ccccc2)c1SC
Systematic name  (3):
  • ベンゼンスルホン酸2,3-ビス(メチルチオ)-4-ヒドロキシ-5,8-ジヒドロ-5,8-メタノナフタレン-1-イル
  • 6-ヒドロキシ-4,5-ビス(メチルスルファニル)トリシクロ[6.2.1.02,7]ウンデカ-2(7),3,5,9-テトラエン-3-イル ベンゼンスルホナート
  • 6-hydroxy-4,5-bis(methylsulfanyl)tricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraen-3-yl benzenesulfonate
Other name (1):
  • Benzenesulfonic acid 2,3-bis(methylthio)-4-hydroxy-5,8-dihydro-5,8-methanonaphthalene-1-yl ester
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