Chem
J-GLOBAL ID：200907098040279970   Nikkaji number：J2.110.269E

4-[(Z)-1-(Methoxymethyl)-2-cyano-1-pentenyl]benzoic acid methyl ester

4-[(Z)-1-(メトキシメチル)-2-シアノ-1-ペンテニル]安息香酸メチル
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： C16H19NO3
Molecular formula furigana： C16-H19-N-O3
Molecular weight： 273.332
InChI： InChI=1S/C16H19NO3/c1-4-5-14(10-17)15(11-19-2)12-6-8-13(9-7-12)16(18)20-3/h6-9H,4-5,11H2,1-3H3/b15-14+
InChI key： JCRHSASDKBPEOB-CCEZHUSRSA-N
SMILES： CCC/C(=C(/COC)\c1ccc(cc1)C(=O)OC)/C#N
Systematic name  (3)：
  • 4-[(Z)-1-(メトキシメチル)-2-シアノ-1-ペンテニル]安息香酸メチル
  • メチル 4-[(1Z)-1-シアノ-3-メトキシ-1-プロピルプロパ-1-エン-2-イル]ベンゾアート
  • methyl 4-[(1Z)-1-cyano-3-methoxy-1-propylprop-1-en-2-yl]benzoate
Other name (1)：
  • 4-[(Z)-1-(Methoxymethyl)-2-cyano-1-pentenyl]benzoic acid methyl ester
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