[(1S,2R,3S,4S,6R)-3-acetyloxy-6-azido-4-oxidanyl-2-phenylmethoxy-4-(phenylmethoxymethyl)cyclohexyl] ethanoate

Systemtic Name: [(1S,2R,3S,4S,6R)-3-acetyloxy-6-azido-4-oxidanyl-2-phenylmethoxy-4-(phenylmethoxymethyl)cyclohexyl] ethanoate Openeye Name: [(1S,2R,3S,4S,6R)-3-acetoxy-6-azido-2-benzyloxy-4-(benzyloxymethyl)-4-hydroxy-cyclohexyl] acetate CAS Name: acetic acid [(1S,2R,3S,4S,6R)-3-acetyloxy-6-azido-4-hydroxy-2-phenylmethoxy-4-(phenylmethoxymethyl)cyclohexyl] ester IUPAC Name: [(1S,2R,3S,4S,6R)-3-acetyloxy-6-azido-4-hydroxy-2-phenylmethoxy-4-(phenylmethoxymethyl)cyclohexyl] acetate Traditional Name: acetic acid [(1S,2R,3S,4S,6R)-3-acetoxy-6-azido-2-benzoxy-4-(benzoxymethyl)-4-hydroxy-cyclohexyl] ester Formula: C25H29N3O7 MolecularWeight: 483.51366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(CC(C(C1OCC2=CC=CC=C2)OC(=O)C)(COCC3=CC=CC=C3)O)N=[N+]=[N-]

Isomeric SMILES

CC(=O)O[C@H]1[C@@H](C[C@@]([C@H]([C@@H]1OCC2=CC=CC=C2)OC(=O)C)(COCC3=CC=CC=C3)O)N=[N+]=[N-]

InChI

InChI=1S/C25H29N3O7/c1-17(29)34-22-21(27-28-26)13-25(31,16-32-14-19-9-5-3-6-10-19)24(35-18(2)30)23(22)33-15-20-11-7-4-8-12-20/h3-12,21-24,31H,13-16H2,1-2H3/t21-,22+,23-,24+,25+/m1/s1