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

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-phenylazanylbenzoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-anilinobenzoate CAS Name: 2-anilinobenzoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-anilinobenzoate Traditional Name: 2-anilinobenzoic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=CC=CC=C1NC2=CC=CC=C2)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC=CC=C1NC2=CC=CC=C2)/N

InChI

InChI=1S/C19H17N3O3/c1-13(21)16(11-20)18(23)12-25-19(24)15-9-5-6-10-17(15)22-14-7-3-2-4-8-14/h2-10,22H,12,21H2,1H3/b16-13+