3-[3-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: 3-[3-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: 3-[3-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxo-prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 3-[3-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]-2,5-dimethyl-1-pyrrolyl]benzoate IUPAC Name: 3-[3-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 3-[3-[(E)-2-cyano-3-keto-3-(p-anisidino)prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Formula: C24H20N3O4- MolecularWeight: 414.4333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)[O-])C)C=C(C#N)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)[O-])C)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H21N3O4/c1-15-11-18(16(2)27(15)21-6-4-5-17(13-21)24(29)30)12-19(14-25)23(28)26-20-7-9-22(31-3)10-8-20/h4-13H,1-3H3,(H,26,28)(H,29,30)/p-1/b19-12+