Chem
J-GLOBAL ID：200907034358971751   Nikkaji number：J672.969J

3-Phenyl-4-oxoheptanedioic acid 1-ethyl ester

3-フェニル-4-オキソヘプタン二酸1-エチル
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： C15H18O5
Molecular formula furigana： C15-H18-O5
Molecular weight： 278.304
InChI： InChI=1S/C15H18O5/c1-2-20-15(19)10-12(11-6-4-3-5-7-11)13(16)8-9-14(17)18/h3-7,12H,2,8-10H2,1H3,(H,17,18)
InChI key： MRTGTOXURDASAX-UHFFFAOYSA-N
SMILES： CCOC(=O)CC(C(=O)CCC(=O)O)c1ccccc1
Systematic name  (3)：
  • 3-フェニル-4-オキソヘプタン二酸1-エチル
  • 7-エトキシ-4,7-ジオキソ-5-フェニルヘプタン酸
  • 7-ethoxy-4,7-dioxo-5-phenylheptanoic acid
Other name (1)：
  • 3-Phenyl-4-oxoheptanedioic acid 1-ethyl ester
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