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

Systemtic Name: ethyl (1S,2R,3R)-2-oxidanyl-3-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylate Openeye Name: ethyl (1S,2R,3R)-3-(benzyloxycarbonylamino)-2-hydroxy-cyclohexanecarboxylate CAS Name: (1S,2R,3R)-2-hydroxy-3-(phenylmethoxycarbonylamino)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R,3R)-2-hydroxy-3-(phenylmethoxycarbonylamino)cyclohexane-1-carboxylate Traditional Name: (1S,2R,3R)-3-(benzyloxycarbonylamino)-2-hydroxy-cyclohexanecarboxylic acid ethyl ester Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]1CCC[C@H]([C@@H]1O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H23NO5/c1-2-22-16(20)13-9-6-10-14(15(13)19)18-17(21)23-11-12-7-4-3-5-8-12/h3-5,7-8,13-15,19H,2,6,9-11H2,1H3,(H,18,21)/t13-,14+,15+/m0/s1