ethyl 4-cyano-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrrole-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrrole-2-carboxylate CAS Name: 4-cyano-3-methyl-1-(4-methylphenyl)-5-(1-pyrrolyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrrole-2-carboxylate Traditional Name: 4-cyano-3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrrole-2-carboxylic acid ethyl ester Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C2=CC=C(C=C2)C)N3C=CC=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C2=CC=C(C=C2)C)N3C=CC=C3)C#N)C

InChI

InChI=1S/C20H19N3O2/c1-4-25-20(24)18-15(3)17(13-21)19(22-11-5-6-12-22)23(18)16-9-7-14(2)8-10-16/h5-12H,4H2,1-3H3