Chem
J-GLOBAL ID：201707009125049990   Nikkaji number：J3.606.056E

4-(Methylsulfonyl)-5-phenyl-4-pentenoic acid methyl ester

4-(メチルスルホニル)-5-フェニル-4-ペンテン酸メチル
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： C13H16O4S
Molecular formula furigana： C13-H16-O4-S
Molecular weight： 268.330
InChI： InChI=1S/C13H16O4S/c1-17-13(14)9-8-12(18(2,15)16)10-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI key： ZYGLGRIHTOCKAK-UHFFFAOYSA-N
SMILES： COC(=O)CCC(=Cc1ccccc1)S(=O)(=O)C
Systematic name  (3)：
  • 4-(メチルスルホニル)-5-フェニル-4-ペンテン酸メチル
  • メチル 4-メタンスルホニル-5-フェニルペンタ-4-エノアート
  • methyl 4-methanesulfonyl-5-phenylpent-4-enoate
Other name (1)：
  • 4-(Methylsulfonyl)-5-phenyl-4-pentenoic acid methyl ester
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