[1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate Openeye Name: [1-methyl-2-oxo-2-(p-tolylmethylamino)ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-1-methyl-2-[(4-methylbenzyl)amino]ethyl] ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C(C)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H18N2O3/c1-13-6-8-15(9-7-13)12-21-18(22)14(2)24-19(23)17-5-3-4-16(10-17)11-20/h3-10,14H,12H2,1-2H3,(H,21,22)