[(1S,2S,4S,5R,6R)-2-acetyloxy-4-azido-5-oxidanyl-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] ethanoate

Systemtic Name: [(1S,2S,4S,5R,6R)-2-acetyloxy-4-azido-5-oxidanyl-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] ethanoate Openeye Name: [(1S,2S,4S,5R,6R)-2-acetoxy-4-azido-6-benzyloxy-2-(benzyloxymethyl)-5-hydroxy-cyclohexyl] acetate CAS Name: acetic acid [(1S,2S,4S,5R,6R)-2-acetyloxy-4-azido-5-hydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] ester IUPAC Name: [(1S,2S,4S,5R,6R)-2-acetyloxy-4-azido-5-hydroxy-6-phenylmethoxy-2-(phenylmethoxymethyl)cyclohexyl] acetate Traditional Name: acetic acid [(1S,2S,4S,5R,6R)-2-acetoxy-4-azido-6-benzoxy-2-(benzoxymethyl)-5-hydroxy-cyclohexyl] ester Formula: C25H29N3O7 MolecularWeight: 483.51366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(CC1(COCC2=CC=CC=C2)OC(=O)C)N=[N+]=[N-])O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@H]1[C@@H]([C@@H]([C@H](C[C@@]1(COCC2=CC=CC=C2)OC(=O)C)N=[N+]=[N-])O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O7/c1-17(29)34-24-23(33-15-20-11-7-4-8-12-20)22(31)21(27-28-26)13-25(24,35-18(2)30)16-32-14-19-9-5-3-6-10-19/h3-12,21-24,31H,13-16H2,1-2H3/t21-,22+,23+,24-,25-/m0/s1