Chem
J-GLOBAL ID：200907016674328781   Nikkaji number：J1.541.365D

2-Methyl-2-[4-(1-hydroxy-2-ethoxy-2-oxoethyl)-5-oxo-7-phenyloxepane-2-yl]propanoic acid methyl ester

2-メチル-2-[4-(1-ヒドロキシ-2-エトキシ-2-オキソエチル)-5-オキソ-7-フェニルオキセパン-2-イル]プロパン酸メチル
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： C21H28O7
Molecular formula furigana： C21-H28-O7
Molecular weight： 392.448
InChI： InChI=1S/C21H28O7/c1-5-27-19(24)18(23)14-11-17(21(2,3)20(25)26-4)28-16(12-15(14)22)13-9-7-6-8-10-13/h6-10,14,16-18,23H,5,11-12H2,1-4H3
InChI key： QIWMCNWZSHGBDO-UHFFFAOYSA-N
SMILES： CCOC(=O)C(O)C1CC(OC(CC1=O)c1ccccc1)C(C)(C)C(=O)OC
Systematic name  (3)：
  • 2-メチル-2-[4-(1-ヒドロキシ-2-エトキシ-2-オキソエチル)-5-オキソ-7-フェニルオキセパン-2-イル]プロパン酸メチル
  • メチル 2-[4-(2-エトキシ-1-ヒドロキシ-2-オキソエチル)-5-オキソ-7-フェニルオキセパン-2-イル]-2-メチルプロパノアート
  • methyl 2-[4-(2-ethoxy-1-hydroxy-2-oxoethyl)-5-oxo-7-phenyloxepan-2-yl]-2-methylpropanoate
Other name (1)：
  • 2-Methyl-2-[4-(1-hydroxy-2-ethoxy-2-oxoethyl)-5-oxo-7-phenyloxepane-2-yl]propanoic acid methyl ester
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