tert-butyl N-[(2S)-1-(4-acetamido-4-cyclohexyl-piperidin-1-yl)-3-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(4-acetamido-4-cyclohexyl-piperidin-1-yl)-3-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-(4-acetamido-4-cyclohexyl-1-piperidyl)-1-[(4-chlorophenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(4-acetamido-4-cyclohexyl-1-piperidinyl)-3-(4-chlorophenyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(4-acetamido-4-cyclohexylpiperidin-1-yl)-3-(4-chlorophenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(4-acetamido-4-cyclohexyl-piperidino)-1-(4-chlorobenzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C27H40ClN3O4 MolecularWeight: 506.0772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CCN(CC1)C(=O)C(CC2=CC=C(C=C2)Cl)NC(=O)OC(C)(C)C)C3CCCCC3

Isomeric SMILES

CC(=O)NC1(CCN(CC1)C(=O)[C@H](CC2=CC=C(C=C2)Cl)NC(=O)OC(C)(C)C)C3CCCCC3

InChI

InChI=1S/C27H40ClN3O4/c1-19(32)30-27(21-8-6-5-7-9-21)14-16-31(17-15-27)24(33)23(29-25(34)35-26(2,3)4)18-20-10-12-22(28)13-11-20/h10-13,21,23H,5-9,14-18H2,1-4H3,(H,29,34)(H,30,32)/t23-/m0/s1