Chem
J-GLOBAL ID：200907003484071607   Nikkaji number：J445.198H

FPL-64176

FPL-64176
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： C22H21NO3
Molecular formula furigana： C22-H21-N-O3
Molecular weight： 347.414
InChI： InChI=1S/C22H21NO3/c1-14-19(20(15(2)23-14)22(25)26-3)21(24)18-12-8-7-11-17(18)13-16-9-5-4-6-10-16/h4-12,23H,13H2,1-3H3
InChI key： MDMWHKZANMNXTF-UHFFFAOYSA-N
SMILES： COC(=O)c1c(C)[nH]c(C)c1C(=O)c1ccccc1Cc1ccccc1
Systematic name  (4)：
  • 2,5-ジメチル-4-(2-ベンジルベンゾイル)-1H-ピロール-3-カルボン酸メチル
  • 4-(2-ベンジルベンゾイル)-2,5-ジメチル-1H-ピロール-3-カルボン酸メチル
  • メチル 4-(2-ベンジルベンゾイル)-2,5-ジメチル-1H-ピロール-3-カルボキシラート
  • methyl 4-(2-benzylbenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Other name (5)：
  • FPL-64176
  • 4-(2-Benzylbenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
  • 2,5-Dimethyl-4-(2-benzylbenzoyl)-1H-pyrrole-3-carboxylic acid methyl ester
  • FPL64176
  • Methyl 2,5-dimethyl-4-[2-(phenylmethyl)benzoyl]-1H-pyrrole-3-carboxylate
CAS registry number： 120934-96-5
KEGG COMPOUND： C13759
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