[5-(4-methylphenyl)sulfonyloxy-3,4-bis(oxidanylidene)hexan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-(4-methylphenyl)sulfonyloxy-3,4-bis(oxidanylidene)hexan-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-methyl-2,3-dioxo-4-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(4-methylphenyl)sulfonyloxy-3,4-dioxohexan-2-yl] ester IUPAC Name: [5-(4-methylphenyl)sulfonyloxy-3,4-dioxohexan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2,3-diketo-1-methyl-4-tosyloxy-pentyl) ester Formula: C20H22O8S2 MolecularWeight: 454.51388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)C(=O)C(C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)C(=O)C(C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H22O8S2/c1-13-5-9-17(10-6-13)29(23,24)27-15(3)19(21)20(22)16(4)28-30(25,26)18-11-7-14(2)8-12-18/h5-12,15-16H,1-4H3