tert-butyl N-[5-[(3-chlorophenyl)methyl]-1-cyclohexyl-6-(methylamino)-3-oxidanyl-6-oxidanylidene-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[5-[(3-chlorophenyl)methyl]-1-cyclohexyl-6-(methylamino)-3-oxidanyl-6-oxidanylidene-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[4-[(3-chlorophenyl)methyl]-1-(cyclohexylmethyl)-2-hydroxy-5-(methylamino)-5-oxo-pentyl]carbamate CAS Name: N-[5-[(3-chlorophenyl)methyl]-1-cyclohexyl-3-hydroxy-6-(methylamino)-6-oxohexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[(3-chlorophenyl)methyl]-1-cyclohexyl-3-hydroxy-6-(methylamino)-6-oxohexan-2-yl]carbamate Traditional Name: N-[4-(3-chlorobenzyl)-1-(cyclohexylmethyl)-2-hydroxy-5-keto-5-(methylamino)pentyl]carbamic acid tert-butyl ester Formula: C25H39ClN2O4 MolecularWeight: 467.04116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CC(CC2=CC(=CC=C2)Cl)C(=O)NC)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CC(CC2=CC(=CC=C2)Cl)C(=O)NC)O

InChI

InChI=1S/C25H39ClN2O4/c1-25(2,3)32-24(31)28-21(15-17-9-6-5-7-10-17)22(29)16-19(23(30)27-4)13-18-11-8-12-20(26)14-18/h8,11-12,14,17,19,21-22,29H,5-7,9-10,13,15-16H2,1-4H3,(H,27,30)(H,28,31)