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

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 3-cyanobenzoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H18N2O3/c1-14(18(22)21-11-10-15-6-3-2-4-7-15)24-19(23)17-9-5-8-16(12-17)13-20/h2-9,12,14H,10-11H2,1H3,(H,21,22)