ethyl 5-[(E)-3-[(4-acetamidophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(E)-3-[(4-acetamidophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxo-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-3-(4-acetamidoanilino)-2-cyano-3-keto-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C=C(C#N)C(=O)NC2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)NC(=O)C)C

InChI

InChI=1S/C21H22N4O4/c1-5-29-21(28)19-12(2)18(23-13(19)3)10-15(11-22)20(27)25-17-8-6-16(7-9-17)24-14(4)26/h6-10,23H,5H2,1-4H3,(H,24,26)(H,25,27)/b15-10+