Chem
J-GLOBAL ID:200907001884665244   Nikkaji number:J724.281F

1-Phenyl-2-(2-oxocyclohexyl)-3-benzoyl-4-hydroxy-5-oxo-3-pyrroline-2β-carboxylic acid ethyl ester

1-フェニル-2-(2-オキソシクロヘキシル)-3-ベンゾイル-4-ヒドロキシ-5-オキソ-3-ピロリン-2β-カルボン酸エチル
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: C26H25NO6
Molecular formula furigana: C26-H25-N-O6
Molecular weight: 447.487
InChI: InChI=1S/C26H25NO6/c1-2-33-25(32)26(19-15-9-10-16-20(19)28)21(22(29)17-11-5-3-6-12-17)23(30)24(31)27(26)18-13-7-4-8-14-18/h3-8,11-14,19,30H,2,9-10,15-16H2,1H3/t19?,26-/m1/s1
InChI key: IBYMPKXRTTUSCW-COTLDPOVSA-N
SMILES: CCOC(=O)[C@]1(C2CCCCC2=O)N(C(=O)C(=C1C(=O)c1ccccc1)O)c1ccccc1
Systematic name  (3):
  • 1-フェニル-2-(2-オキソシクロヘキシル)-3-ベンゾイル-4-ヒドロキシ-5-オキソ-3-ピロリン-2β-カルボン酸エチル
  • エチル (2R)-3-ベンゾイル-4-ヒドロキシ-5-オキソ-2-(2-オキソシクロヘキシル)-1-フェニル-2,5-ジヒドロ-1H-ピロール-2-カルボキシラート
  • ethyl (2R)-3-benzoyl-4-hydroxy-5-oxo-2-(2-oxocyclohexyl)-1-phenyl-2,5-dihydro-1H-pyrrole-2-carboxylate
Other name (1):
  • 1-Phenyl-2-(2-oxocyclohexyl)-3-benzoyl-4-hydroxy-5-oxo-3-pyrroline-2β-carboxylic acid ethyl ester
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