N-cyclohexylcyclohexanamine; (2S,3R)-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: N-cyclohexylcyclohexanamine; (2S,3R)-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: (2S,3R)-3-benzyloxy-2-(benzyloxycarbonylamino)butanoic acid; N-cyclohexylcyclohexanamine CAS Name: N-cyclohexylcyclohexanamine; (2S,3R)-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: N-cyclohexylcyclohexanamine; (2S,3R)-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: (2S,3R)-3-benzoxy-2-(benzyloxycarbonylamino)butyric acid; dicyclohexylamine Formula: C31H44N2O5 MolecularWeight: 524.69146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)OCC1=CC=CC=C1)OCC2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

C[C@H]([C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1)OCC2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C19H21NO5.C12H23N/c1-14(24-12-15-8-4-2-5-9-15)17(18(21)22)20-19(23)25-13-16-10-6-3-7-11-16;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h2-11,14,17H,12-13H2,1H3,(H,20,23)(H,21,22);11-13H,1-10H2/t14-,17+;/m1./s1