N-cyclohexylcyclohexanamine; (2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[2-(4-phenylphenyl)propan-2-yloxycarbonylamino]hexanoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; (2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[2-(4-phenylphenyl)propan-2-yloxycarbonylamino]hexanoic acid Openeye Name: (2S)-6-(tert-butoxycarbonylamino)-2-[[1-methyl-1-(4-phenylphenyl)ethoxy]carbonylamino]hexanoic acid; N-cyclohexylcyclohexanamine CAS Name: N-cyclohexylcyclohexanamine; (2S)-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[[oxo-[2-(4-phenylphenyl)propan-2-yloxy]methyl]amino]hexanoic acid IUPAC Name: N-cyclohexylcyclohexanamine; (2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[2-(4-phenylphenyl)propan-2-yloxycarbonylamino]hexanoic acid Traditional Name: (2S)-6-(tert-butoxycarbonylamino)-2-[[1-methyl-1-(4-phenylphenyl)ethoxy]carbonylamino]hexanoic acid; dicyclohexylamine Formula: C39H59N3O6 MolecularWeight: 665.90226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(C(=O)O)NC(=O)OC(C)(C)C1=CC=C(C=C1)C2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C1=CC=C(C=C1)C2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C27H36N2O6.C12H23N/c1-26(2,3)34-24(32)28-18-10-9-13-22(23(30)31)29-25(33)35-27(4,5)21-16-14-20(15-17-21)19-11-7-6-8-12-19;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h6-8,11-12,14-17,22H,9-10,13,18H2,1-5H3,(H,28,32)(H,29,33)(H,30,31);11-13H,1-10H2/t22-;/m0./s1