[(2S,3S)-4-(4-methylphenyl)sulfonyloxy-2-oxidanyl-3-phenylmethoxy-butyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,3S)-4-(4-methylphenyl)sulfonyloxy-2-oxidanyl-3-phenylmethoxy-butyl] 4-methylbenzenesulfonate Openeye Name: [(2S,3S)-3-benzyloxy-2-hydroxy-4-(p-tolylsulfonyloxy)butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3S)-2-hydroxy-4-(4-methylphenyl)sulfonyloxy-3-phenylmethoxybutyl] ester IUPAC Name: [(2S,3S)-2-hydroxy-4-(4-methylphenyl)sulfonyloxy-3-phenylmethoxybutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3S)-3-benzoxy-2-hydroxy-4-tosyloxy-butyl] ester Formula: C25H28O8S2 MolecularWeight: 520.61502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(COS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]([C@H](COS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3)O

InChI

InChI=1S/C25H28O8S2/c1-19-8-12-22(13-9-19)34(27,28)32-17-24(26)25(31-16-21-6-4-3-5-7-21)18-33-35(29,30)23-14-10-20(2)11-15-23/h3-15,24-26H,16-18H2,1-2H3/t24-,25-/m0/s1