[(2S,4R,5R)-2-azido-3,3-bis(fluoranyl)-6-methylsulfonyloxy-5-oxidanyl-4-phenylmethoxy-hexyl] benzoate

Systemtic Name: [(2S,4R,5R)-2-azido-3,3-bis(fluoranyl)-6-methylsulfonyloxy-5-oxidanyl-4-phenylmethoxy-hexyl] benzoate Openeye Name: [(2S,4R,5R)-2-azido-4-benzyloxy-3,3-difluoro-5-hydroxy-6-methylsulfonyloxy-hexyl] benzoate CAS Name: benzoic acid [(2S,4R,5R)-2-azido-3,3-difluoro-5-hydroxy-6-methylsulfonyloxy-4-phenylmethoxyhexyl] ester IUPAC Name: [(2S,4R,5R)-2-azido-3,3-difluoro-5-hydroxy-6-methylsulfonyloxy-4-phenylmethoxyhexyl] benzoate Traditional Name: benzoic acid [(2S,4R,5R)-2-azido-4-benzoxy-3,3-difluoro-5-hydroxy-6-methylsulfonyloxy-hexyl] ester Formula: C21H23F2N3O7S MolecularWeight: 499.485026

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(C(C(C(COC(=O)C1=CC=CC=C1)N=[N+]=[N-])(F)F)OCC2=CC=CC=C2)O

Isomeric SMILES

CS(=O)(=O)OC[C@H]([C@H](C([C@H](COC(=O)C1=CC=CC=C1)N=[N+]=[N-])(F)F)OCC2=CC=CC=C2)O

InChI

InChI=1S/C21H23F2N3O7S/c1-34(29,30)33-13-17(27)19(31-12-15-8-4-2-5-9-15)21(22,23)18(25-26-24)14-32-20(28)16-10-6-3-7-11-16/h2-11,17-19,27H,12-14H2,1H3/t17-,18+,19-/m1/s1