[5-acetamido-2-(azidomethyl)-4-methylsulfonyloxy-6-phenylmethoxy-oxan-3-yl] methanesulfonate

Systemtic Name: [5-acetamido-2-(azidomethyl)-4-methylsulfonyloxy-6-phenylmethoxy-oxan-3-yl] methanesulfonate Openeye Name: [5-acetamido-2-(azidomethyl)-6-benzyloxy-4-methylsulfonyloxy-tetrahydropyran-3-yl] methanesulfonate CAS Name: methanesulfonic acid [5-acetamido-2-(azidomethyl)-4-methylsulfonyloxy-6-phenylmethoxy-3-oxanyl] ester IUPAC Name: [5-acetamido-2-(azidomethyl)-4-methylsulfonyloxy-6-phenylmethoxyoxan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [5-acetamido-2-(azidomethyl)-6-benzoxy-4-methylsulfonyloxy-tetrahydropyran-3-yl] ester Formula: C17H24N4O9S2 MolecularWeight: 492.52386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)CN=[N+]=[N-])OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)CN=[N+]=[N-])OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C17H24N4O9S2/c1-11(22)20-14-16(30-32(3,25)26)15(29-31(2,23)24)13(9-19-21-18)28-17(14)27-10-12-7-5-4-6-8-12/h4-8,13-17H,9-10H2,1-3H3,(H,20,22)