[2-[5-(4-methylphenyl)sulfonyloxy-1,3-dioxan-4-yl]-2-oxidanyl-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-[5-(4-methylphenyl)sulfonyloxy-1,3-dioxan-4-yl]-2-oxidanyl-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-hydroxy-2-[5-(p-tolylsulfonyloxy)-1,3-dioxan-4-yl]ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-2-[5-(4-methylphenyl)sulfonyloxy-1,3-dioxan-4-yl]ethyl] ester IUPAC Name: [2-hydroxy-2-[5-(4-methylphenyl)sulfonyloxy-1,3-dioxan-4-yl]ethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-hydroxy-2-(5-tosyloxy-1,3-dioxan-4-yl)ethyl] ester Formula: C20H24O9S2 MolecularWeight: 472.52916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2C(COCO2)OS(=O)(=O)C3=CC=C(C=C3)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2C(COCO2)OS(=O)(=O)C3=CC=C(C=C3)C)O

InChI

InChI=1S/C20H24O9S2/c1-14-3-7-16(8-4-14)30(22,23)28-11-18(21)20-19(12-26-13-27-20)29-31(24,25)17-9-5-15(2)6-10-17/h3-10,18-21H,11-13H2,1-2H3