[2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[4-(4-bromophenyl)phenyl]-2-oxo-ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-[4-(4-bromophenyl)phenyl]-2-keto-ethyl] ester Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H16BrNO4/c1-13(24)17-10-19(23-11-17)21(26)27-12-20(25)16-4-2-14(3-5-16)15-6-8-18(22)9-7-15/h2-11,23H,12H2,1H3