methyl 4-[[(E)-2-cyano-3-[(3-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-2-cyano-3-[(3-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: methyl 4-[[(E)-2-cyano-3-(3-methylanilino)-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-(3-methylanilino)-3-oxoprop-1-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-2-cyano-3-(3-methylanilino)-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-keto-3-(m-toluidino)prop-1-enyl]amino]benzoic acid methyl ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=CNC2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C/NC2=CC=C(C=C2)C(=O)OC)/C#N

InChI

InChI=1S/C19H17N3O3/c1-13-4-3-5-17(10-13)22-18(23)15(11-20)12-21-16-8-6-14(7-9-16)19(24)25-2/h3-10,12,21H,1-2H3,(H,22,23)/b15-12+