[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 3,3-diphenylpropanoate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 3,3-diphenylpropanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 3,3-diphenylpropanoate CAS Name: 3,3-diphenylpropanoic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 3,3-diphenylpropanoate Traditional Name: 3,3-diphenylpropionic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C25H28N2O3 MolecularWeight: 404.50142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-19(24(29)27-25(18-26)15-9-4-10-16-25)30-23(28)17-22(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-3,5-8,11-14,19,22H,4,9-10,15-17H2,1H3,(H,27,29)