[(1S,2S,6S)-2-oxidanyl-6-(phenylmethoxycarbonylamino)cyclohept-3-en-1-yl] ethanoate

Systemtic Name: [(1S,2S,6S)-2-oxidanyl-6-(phenylmethoxycarbonylamino)cyclohept-3-en-1-yl] ethanoate Openeye Name: [(1S,2S,6S)-6-(benzyloxycarbonylamino)-2-hydroxy-cyclohept-3-en-1-yl] acetate CAS Name: acetic acid [(1S,2S,6S)-2-hydroxy-6-(phenylmethoxycarbonylamino)-1-cyclohept-3-enyl] ester IUPAC Name: [(1S,2S,6S)-2-hydroxy-6-(phenylmethoxycarbonylamino)cyclohept-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,2S,6S)-6-(benzyloxycarbonylamino)-2-hydroxy-cyclohept-3-en-1-yl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(CC=CC1O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-12(19)23-16-10-14(8-5-9-15(16)20)18-17(21)22-11-13-6-3-2-4-7-13/h2-7,9,14-16,20H,8,10-11H2,1H3,(H,18,21)/t14-,15-,16-/m0/s1