Chem
J-GLOBAL ID：200907033392213657   Nikkaji number：J545.397F

2-(p-Tolylsulfinyl)maleic acid 1-benzyl 4-methyl ester

2-(p-トリルスルフィニル)マレイン酸1-ベンジル4-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： C19H18O5S
Molecular formula furigana： C19-H18-O5-S
Molecular weight： 358.410
InChI： InChI=1S/C19H18O5S/c1-14-8-10-16(11-9-14)25(22)17(12-18(20)23-2)19(21)24-13-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3/b17-12+
InChI key： RUXNBYQSLGWDEN-SFQUDFHCSA-N
SMILES： COC(=O)/C=C(\C(=O)OCc1ccccc1)/S(=O)c1ccc(C)cc1
Systematic name  (4)：
  • 2-[(4-メチルフェニル)スルフィニル]マレイン酸1-ベンジル4-メチル
  • 2-(p-トリルスルフィニル)マレイン酸1-ベンジル4-メチル
  • 1-ベンジル 4-メチル (2E)-2-(4-メチルベンゼンスルフィニル)ブタ-2-エンジオアート
  • 1-benzyl 4-methyl (2E)-2-(4-methylbenzenesulfinyl)but-2-enedioate
Other name (2)：
  • 2-(p-Tolylsulfinyl)maleic acid 1-benzyl 4-methyl ester
  • 2-[(4-Methylphenyl)sulfinyl]maleic acid 1-benzyl 4-methyl ester
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