[(2R,3S,5R,6S)-5-acetamido-3-methylsulfonyloxy-6-phenylmethoxy-oxan-2-yl]methyl methanesulfonate

Systemtic Name: [(2R,3S,5R,6S)-5-acetamido-3-methylsulfonyloxy-6-phenylmethoxy-oxan-2-yl]methyl methanesulfonate Openeye Name: [(2R,3S,5R,6S)-5-acetamido-6-benzyloxy-3-methylsulfonyloxy-tetrahydropyran-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2R,3S,5R,6S)-5-acetamido-3-methylsulfonyloxy-6-phenylmethoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,5R,6S)-5-acetamido-3-methylsulfonyloxy-6-phenylmethoxyoxan-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2R,3S,5R,6S)-5-acetamido-6-benzoxy-3-methylsulfonyloxy-tetrahydropyran-2-yl]methyl ester Formula: C17H25NO9S2 MolecularWeight: 451.5117

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CC(C(OC1OCC2=CC=CC=C2)COS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1C[C@@H]([C@H](O[C@@H]1OCC2=CC=CC=C2)COS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C17H25NO9S2/c1-12(19)18-14-9-15(27-29(3,22)23)16(11-25-28(2,20)21)26-17(14)24-10-13-7-5-4-6-8-13/h4-8,14-17H,9-11H2,1-3H3,(H,18,19)/t14-,15+,16-,17+/m1/s1