4-[(E)-2-cyano-3-[(2,6-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: 4-[(E)-2-cyano-3-[(2,6-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-2-cyano-3-(2,6-dimethylanilino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-cyano-3-(2,6-dimethylanilino)-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-2-cyano-3-(2,6-dimethylanilino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-2-cyano-3-(2,6-dimethylanilino)-3-keto-prop-1-enyl]benzoate Formula: C19H15N2O3- MolecularWeight: 319.334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C#N

InChI

InChI=1S/C19H16N2O3/c1-12-4-3-5-13(2)17(12)21-18(22)16(11-20)10-14-6-8-15(9-7-14)19(23)24/h3-10H,1-2H3,(H,21,22)(H,23,24)/p-1/b16-10+