Chem
J-GLOBAL ID:200907077467011807   Nikkaji number:J1.360.899G

1-Benzyl-3-(trifluoromethyl)-4-(trifluoroacetyl)-1H-pyrrole-2-carboxylic acid

1-ベンジル-3-(トリフルオロメチル)-4-(トリフルオロアセチル)-1H-ピロール-2-カルボン酸
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: C15H9F6NO3
Molecular formula furigana: C15-H9-F6-N-O3
Molecular weight: 365.231
InChI: InChI=1S/C15H9F6NO3/c16-14(17,18)10-9(12(23)15(19,20)21)7-22(11(10)13(24)25)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,24,25)
InChI key: AYBWREONYOINCO-UHFFFAOYSA-N
SMILES: OC(=O)c1c(c(cn1Cc1ccccc1)C(=O)C(F)(F)F)C(F)(F)F
Systematic name  (3):
  • 1-ベンジル-3-(トリフルオロメチル)-4-(トリフルオロアセチル)-1H-ピロール-2-カルボン酸
  • 1-ベンジル-4-(2,2,2-トリフルオロアセチル)-3-(トリフルオロメチル)-1H-ピロール-2-カルボン酸
  • 1-benzyl-4-(2,2,2-trifluoroacetyl)-3-(trifluoromethyl)-1H-pyrrole-2-carboxylic acid
Other name (1):
  • 1-Benzyl-3-(trifluoromethyl)-4-(trifluoroacetyl)-1H-pyrrole-2-carboxylic acid
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