[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-(4-cyanophenyl)propanoate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-(4-cyanophenyl)propanoate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O3 MolecularWeight: 302.36818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)CCC1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)CNC(=O)C(C)OC(=O)CCC1=CC=C(C=C1)C#N

InChI

InChI=1S/C17H22N2O3/c1-12(2)11-19-17(21)13(3)22-16(20)9-8-14-4-6-15(10-18)7-5-14/h4-7,12-13H,8-9,11H2,1-3H3,(H,19,21)