(phenylmethyl) (1S,2S,3R)-2-oxidanyl-3-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylate

Systemtic Name: (phenylmethyl) (1S,2S,3R)-2-oxidanyl-3-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylate Openeye Name: benzyl (1S,2S,3R)-3-(benzyloxycarbonylamino)-2-hydroxy-cyclohexanecarboxylate CAS Name: (1S,2S,3R)-2-hydroxy-3-(phenylmethoxycarbonylamino)-1-cyclohexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,2S,3R)-2-hydroxy-3-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylate Traditional Name: (1S,2S,3R)-3-(benzyloxycarbonylamino)-2-hydroxy-cyclohexanecarboxylic acid benzyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1)NC(=O)OCC2=CC=CC=C2)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]([C@@H]([C@@H](C1)NC(=O)OCC2=CC=CC=C2)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO5/c24-20-18(21(25)27-14-16-8-3-1-4-9-16)12-7-13-19(20)23-22(26)28-15-17-10-5-2-6-11-17/h1-6,8-11,18-20,24H,7,12-15H2,(H,23,26)/t18-,19+,20-/m0/s1