Chem
J-GLOBAL ID：200907000939177728   Nikkaji number：J1.559.633C

(S)-1-Benzyl-2-methyl-4-oxo-2-cyclohexene-1β-carboxylic acid methyl ester

(S)-1-ベンジル-2-メチル-4-オキソ-2-シクロヘキセン-1β-カルボン酸メチル
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： C16H18O3
Molecular formula furigana： C16-H18-O3
Molecular weight： 258.317
InChI： InChI=1S/C16H18O3/c1-12-10-14(17)8-9-16(12,15(18)19-2)11-13-6-4-3-5-7-13/h3-7,10H,8-9,11H2,1-2H3/t16-/m0/s1
InChI key： PVSIHXDMIXBKIJ-INIZCTEOSA-N
SMILES： COC(=O)[C@]1(Cc2ccccc2)CCC(=O)C=C1C
Systematic name  (3)：
  • (S)-1-ベンジル-2-メチル-4-オキソ-2-シクロヘキセン-1β-カルボン酸メチル
  • メチル (1S)-1-ベンジル-2-メチル-4-オキソシクロヘキサ-2-エン-1-カルボキシラート
  • methyl (1S)-1-benzyl-2-methyl-4-oxocyclohex-2-ene-1-carboxylate
Other name (1)：
  • (S)-1-Benzyl-2-methyl-4-oxo-2-cyclohexene-1β-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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