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

Systemtic Name: ethyl 5-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxidanylidene-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxo-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-3-(4-chlorophenyl)-2-cyano-3-oxoprop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-3-(4-chlorophenyl)-2-cyano-3-keto-prop-1-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H17ClN2O3 MolecularWeight: 356.80288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN2O3/c1-4-25-19(24)17-11(2)16(22-12(17)3)9-14(10-21)18(23)13-5-7-15(20)8-6-13/h5-9,22H,4H2,1-3H3/b14-9+