diethyl 4-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-1H-pyrrole-2,3-dicarboxylate

Systemtic Name: diethyl 4-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-1H-pyrrole-2,3-dicarboxylate Openeye Name: diethyl 4-[[4-(4-chlorobenzoyl)phenyl]methyl]-1H-pyrrole-2,3-dicarboxylate CAS Name: 4-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-1H-pyrrole-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[[4-(4-chlorobenzoyl)phenyl]methyl]-1H-pyrrole-2,3-dicarboxylate Traditional Name: 4-[4-(4-chlorobenzoyl)benzyl]-1H-pyrrole-2,3-dicarboxylic acid diethyl ester Formula: C24H22ClNO5 MolecularWeight: 439.88818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC=C1CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(NC=C1CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C24H22ClNO5/c1-3-30-23(28)20-18(14-26-21(20)24(29)31-4-2)13-15-5-7-16(8-6-15)22(27)17-9-11-19(25)12-10-17/h5-12,14,26H,3-4,13H2,1-2H3