[1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4-cyclohexyl-1-oxidanylidene-butan-2-yl] morpholine-4-carboxylate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4-cyclohexyl-1-oxidanylidene-butan-2-yl] morpholine-4-carboxylate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)carbamoyl]-3-cyclohexyl-propyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4-cyclohexyl-1-oxobutan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4-cyclohexyl-1-oxobutan-2-yl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [1-[(2-benzoxy-1-cyano-ethyl)carbamoyl]-3-cyclohexyl-propyl] ester Formula: C25H35N3O5 MolecularWeight: 457.5625

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(C(=O)NC(COCC2=CC=CC=C2)C#N)OC(=O)N3CCOCC3

Isomeric SMILES

C1CCC(CC1)CCC(C(=O)NC(COCC2=CC=CC=C2)C#N)OC(=O)N3CCOCC3

InChI

InChI=1S/C25H35N3O5/c26-17-22(19-32-18-21-9-5-2-6-10-21)27-24(29)23(12-11-20-7-3-1-4-8-20)33-25(30)28-13-15-31-16-14-28/h2,5-6,9-10,20,22-23H,1,3-4,7-8,11-16,18-19H2,(H,27,29)