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

Systemtic Name: 2-[3-[2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Openeye Name: 2-[3-[2-cyano-3-(4-methoxyanilino)-3-oxo-prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid CAS Name: 2-[3-[2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid IUPAC Name: 2-[3-[2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]-2,5-dimethylpyrrol-1-yl]benzoic acid Traditional Name: 2-[3-[2-cyano-3-keto-3-(p-anisidino)prop-1-enyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2C(=O)O)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2C(=O)O)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)OC

InChI

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