[1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-3-(2,2-dimethylcyclohexyl)-1-oxidanylidene-propan-2-yl] morpholine-4-carboxylate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-3-(2,2-dimethylcyclohexyl)-1-oxidanylidene-propan-2-yl] morpholine-4-carboxylate Openeye Name: [2-[(2-benzyloxy-1-cyano-ethyl)amino]-1-[(2,2-dimethylcyclohexyl)methyl]-2-oxo-ethyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-[(1-cyano-2-phenylmethoxyethyl)amino]-3-(2,2-dimethylcyclohexyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)amino]-3-(2,2-dimethylcyclohexyl)-1-oxopropan-2-yl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [2-[(2-benzoxy-1-cyano-ethyl)amino]-1-[(2,2-dimethylcyclohexyl)methyl]-2-keto-ethyl] ester Formula: C26H37N3O5 MolecularWeight: 471.58908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1CC(C(=O)NC(COCC2=CC=CC=C2)C#N)OC(=O)N3CCOCC3)C

Isomeric SMILES

CC1(CCCCC1CC(C(=O)NC(COCC2=CC=CC=C2)C#N)OC(=O)N3CCOCC3)C

InChI

InChI=1S/C26H37N3O5/c1-26(2)11-7-6-10-21(26)16-23(34-25(31)29-12-14-32-15-13-29)24(30)28-22(17-27)19-33-18-20-8-4-3-5-9-20/h3-5,8-9,21-23H,6-7,10-16,18-19H2,1-2H3,(H,28,30)