ethyl 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)-1-oxopenta-2,4-dienyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C(=CC=CC2=CC=CC=C2OC)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)/C(=C/C=C/C2=CC=CC=C2OC)/C#N)C)C

InChI

InChI=1S/C22H22N2O4/c1-5-28-22(26)20-15(3)24-14(2)19(20)21(25)17(13-23)11-8-10-16-9-6-7-12-18(16)27-4/h6-12,24H,5H2,1-4H3/b10-8+,17-11+