[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-phenylbenzoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-phenylbenzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)/N

InChI

InChI=1S/C19H16N2O3/c1-13(21)17(11-20)18(22)12-24-19(23)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10H,12,21H2,1H3/b17-13+