[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-cyanobenzoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H16N2O3/c1-13(17(21)20-12-14-6-3-2-4-7-14)23-18(22)16-9-5-8-15(10-16)11-19/h2-10,13H,12H2,1H3,(H,20,21)