[1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4,4-dimethyl-1-oxidanylidene-hexan-2-yl] morpholine-4-carboxylate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)amino]-4,4-dimethyl-1-oxidanylidene-hexan-2-yl] morpholine-4-carboxylate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)carbamoyl]-3,3-dimethyl-pentyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4,4-dimethyl-1-oxohexan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)amino]-4,4-dimethyl-1-oxohexan-2-yl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [1-[(2-benzoxy-1-cyano-ethyl)carbamoyl]-3,3-dimethyl-pentyl] ester Formula: C23H33N3O5 MolecularWeight: 431.52522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CC(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)N2CCOCC2

Isomeric SMILES

CCC(C)(C)CC(C(=O)NC(COCC1=CC=CC=C1)C#N)OC(=O)N2CCOCC2

InChI

InChI=1S/C23H33N3O5/c1-4-23(2,3)14-20(31-22(28)26-10-12-29-13-11-26)21(27)25-19(15-24)17-30-16-18-8-6-5-7-9-18/h5-9,19-20H,4,10-14,16-17H2,1-3H3,(H,25,27)