[2-(4-methylphenyl)sulfonyloxy-3,4,5,6-tetrakis(oxidanyl)hexyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(4-methylphenyl)sulfonyloxy-3,4,5,6-tetrakis(oxidanyl)hexyl] 4-methylbenzenesulfonate Openeye Name: [3,4,5,6-tetrahydroxy-2-(p-tolylsulfonyloxy)hexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,4,5,6-tetrahydroxy-2-(4-methylphenyl)sulfonyloxyhexyl] ester IUPAC Name: [3,4,5,6-tetrahydroxy-2-(4-methylphenyl)sulfonyloxyhexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,4,5,6-tetrahydroxy-2-tosyloxy-hexyl) ester Formula: C20H26O10S2 MolecularWeight: 490.54444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C(C(CO)O)O)O)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C(C(CO)O)O)O)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H26O10S2/c1-13-3-7-15(8-4-13)31(25,26)29-12-18(20(24)19(23)17(22)11-21)30-32(27,28)16-9-5-14(2)6-10-16/h3-10,17-24H,11-12H2,1-2H3