[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-(1-methylcyclohexyl)-1-oxidanylidene-propan-2-yl] morpholine-4-carboxylate

Systemtic Name: [1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-(1-methylcyclohexyl)-1-oxidanylidene-propan-2-yl] morpholine-4-carboxylate Openeye Name: [2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-[(1-methylcyclohexyl)methyl]-2-oxo-ethyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-(1-methylcyclohexyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-(1-methylcyclohexyl)-1-oxopropan-2-yl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [2-[(4-cyano-1-methyl-4-piperidyl)amino]-2-keto-1-[(1-methylcyclohexyl)methyl]ethyl] ester Formula: C22H36N4O4 MolecularWeight: 420.54564

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)CC(C(=O)NC2(CCN(CC2)C)C#N)OC(=O)N3CCOCC3

Isomeric SMILES

CC1(CCCCC1)CC(C(=O)NC2(CCN(CC2)C)C#N)OC(=O)N3CCOCC3

InChI

InChI=1S/C22H36N4O4/c1-21(6-4-3-5-7-21)16-18(30-20(28)26-12-14-29-15-13-26)19(27)24-22(17-23)8-10-25(2)11-9-22/h18H,3-16H2,1-2H3,(H,24,27)