[1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3,4-difluorophenyl)-1-methyl-2-oxo-ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [1-(3,4-difluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-difluorophenyl)-1-oxopropan-2-yl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-(3,4-difluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C16H13F2NO4 MolecularWeight: 321.275526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=C(C=C1)F)F)OC(=O)C2=CC(=CN2)C(=O)C

Isomeric SMILES

CC(C(=O)C1=CC(=C(C=C1)F)F)OC(=O)C2=CC(=CN2)C(=O)C

InChI

InChI=1S/C16H13F2NO4/c1-8(20)11-6-14(19-7-11)16(22)23-9(2)15(21)10-3-4-12(17)13(18)5-10/h3-7,9,19H,1-2H3