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

Systemtic Name: 4-[(E)-3-[(4-acetamidophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-3-(4-acetamidoanilino)-2-cyano-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(4-acetamidoanilino)-2-cyano-3-keto-prop-1-enyl]benzoate Formula: C19H14N3O4- MolecularWeight: 348.33216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C#N

InChI

InChI=1S/C19H15N3O4/c1-12(23)21-16-6-8-17(9-7-16)22-18(24)15(11-20)10-13-2-4-14(5-3-13)19(25)26/h2-10H,1H3,(H,21,23)(H,22,24)(H,25,26)/p-1/b15-10+