[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 3-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 3-cyanobenzoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H16N2O4/c1-2-18(23)21-16-8-6-14(7-9-16)17(22)12-25-19(24)15-5-3-4-13(10-15)11-20/h3-10H,2,12H2,1H3,(H,21,23)