ethyl (5Z)-2-methyl-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5Z)-2-methyl-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5Z)-2-methyl-4-oxo-5-(p-tolylmethylene)-1H-pyrrole-3-carboxylate CAS Name: (5Z)-2-methyl-5-[(4-methylphenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-methyl-5-[(4-methylphenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5Z)-4-keto-2-methyl-5-(4-methylbenzylidene)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC2=CC=C(C=C2)C)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C\C2=CC=C(C=C2)C)/C1=O)C

InChI

InChI=1S/C16H17NO3/c1-4-20-16(19)14-11(3)17-13(15(14)18)9-12-7-5-10(2)6-8-12/h5-9,17H,4H2,1-3H3/b13-9-