[(2S,4S)-5-(4-methylphenyl)sulfonyloxy-2,4-bis(oxidanyl)pentyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,4S)-5-(4-methylphenyl)sulfonyloxy-2,4-bis(oxidanyl)pentyl] 4-methylbenzenesulfonate Openeye Name: [(2S,4S)-2,4-dihydroxy-5-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,4S)-2,4-dihydroxy-5-(4-methylphenyl)sulfonyloxypentyl] ester IUPAC Name: [(2S,4S)-2,4-dihydroxy-5-(4-methylphenyl)sulfonyloxypentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,4S)-2,4-dihydroxy-5-tosyloxy-pentyl] ester Formula: C19H24O8S2 MolecularWeight: 444.51906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24O8S2/c1-14-3-7-18(8-4-14)28(22,23)26-12-16(20)11-17(21)13-27-29(24,25)19-9-5-15(2)6-10-19/h3-10,16-17,20-21H,11-13H2,1-2H3/t16-,17-/m0/s1