methyl 1-[(2R)-1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(2R)-1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[(1R)-2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[(2R)-1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2R)-1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl]piperidine-4-carboxylate Traditional Name: 1-[(1R)-2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl]isonipecotic acid methyl ester Formula: C17H27N3O3 MolecularWeight: 321.41458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)N2CCC(CC2)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C17H27N3O3/c1-13(20-10-6-14(7-11-20)16(22)23-2)15(21)19-17(12-18)8-4-3-5-9-17/h13-14H,3-11H2,1-2H3,(H,19,21)/t13-/m1/s1