Chem
J-GLOBAL ID：200907093004575235   Nikkaji number：J2.558.310H

Benzoic acid [(3aβ,6aβ)-tetrahydro-2,2-dimethylthieno[3,4-d]-1,3-dioxole-4β-yl]methyl ester

安息香酸[(3aβ,6aβ)-テトラヒドロ-2,2-ジメチルチエノ[3,4-d]-1,3-ジオキソール-4β-イル]メチル
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： C15H18O4S
Molecular formula furigana： C15-H18-O4-S
Molecular weight： 294.370
InChI： InChI=1S/C15H18O4S/c1-15(2)18-11-9-20-12(13(11)19-15)8-17-14(16)10-6-4-3-5-7-10/h3-7,11-13H,8-9H2,1-2H3/t11-,12+,13-/m0/s1
InChI key： GVDGGDZDDZVKBN-XQQFMLRXSA-N
SMILES： CC1(C)O[C@H]2CS[C@H](COC(=O)c3ccccc3)[C@H]2O1
Systematic name  (3)：
  • 安息香酸[(3aβ,6aβ)-テトラヒドロ-2,2-ジメチルチエノ[3,4-d]-1,3-ジオキソール-4β-イル]メチル
  • [(3aS,4R,6aR)-2,2-ジメチル-テトラヒドロ-2H-チエノ[3,4-d][1,3]ジオキソール-4-イル]メチル ベンゾアート
  • [(3aS,4R,6aR)-2,2-dimethyl-tetrahydro-2H-thieno[3,4-d][1,3]dioxol-4-yl]methyl benzoate
Other name (1)：
  • Benzoic acid [(3aβ,6aβ)-tetrahydro-2,2-dimethylthieno[3,4-d]-1,3-dioxole-4β-yl]methyl ester
Thsaurus map：
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