[(2S,3S)-4-azido-3-methoxy-2-(4-methylphenyl)sulfonyloxy-butyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,3S)-4-azido-3-methoxy-2-(4-methylphenyl)sulfonyloxy-butyl] 4-methylbenzenesulfonate Openeye Name: [(2S,3S)-4-azido-3-methoxy-2-(p-tolylsulfonyloxy)butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3S)-4-azido-3-methoxy-2-(4-methylphenyl)sulfonyloxybutyl] ester IUPAC Name: [(2S,3S)-4-azido-3-methoxy-2-(4-methylphenyl)sulfonyloxybutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3S)-4-azido-3-methoxy-2-tosyloxy-butyl] ester Formula: C19H23N3O7S2 MolecularWeight: 469.53182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(CN=[N+]=[N-])OC)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]([C@H](CN=[N+]=[N-])OC)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H23N3O7S2/c1-14-4-8-16(9-5-14)30(23,24)28-13-19(18(27-3)12-21-22-20)29-31(25,26)17-10-6-15(2)7-11-17/h4-11,18-19H,12-13H2,1-3H3/t18-,19-/m0/s1