[(4-chlorophenyl)-phenyl-methyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: [(4-chlorophenyl)-phenyl-methyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: [(4-chlorophenyl)-phenyl-methyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(4-chlorophenyl)-phenylmethyl] ester IUPAC Name: [(4-chlorophenyl)-phenylmethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(4-chlorophenyl)-phenyl-methyl] ester Formula: C22H20ClNO3 MolecularWeight: 381.8521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)OC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)OC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20ClNO3/c1-13-19(15(3)25)14(2)24-20(13)22(26)27-21(16-7-5-4-6-8-16)17-9-11-18(23)12-10-17/h4-12,21,24H,1-3H3