ethyl 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylate CAS Name: 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(4-cyanophenyl)-5-methyl-2-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C#N)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C#N)C)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O2/c1-3-25-21(24)19-18(16-11-9-15(13-22)10-12-16)14(2)23-20(19)17-7-5-4-6-8-17/h4-12,23H,3H2,1-2H3