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

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 3-phenoxybenzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 3-phenoxybenzoate CAS Name: 3-phenoxybenzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 3-phenoxybenzoate Traditional Name: 3-phenoxybenzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C19H16N2O4 MolecularWeight: 336.34134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CC(=CC=C1)OC2=CC=CC=C2)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC(=CC=C1)OC2=CC=CC=C2)/N

InChI

InChI=1S/C19H16N2O4/c1-13(21)17(11-20)18(22)12-24-19(23)14-6-5-9-16(10-14)25-15-7-3-2-4-8-15/h2-10H,12,21H2,1H3/b17-13+