[3-(4-methylphenyl)sulfonyloxy-1,4-bis(oxidanylidene)butan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [3-(4-methylphenyl)sulfonyloxy-1,4-bis(oxidanylidene)butan-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-formyl-3-oxo-2-(p-tolylsulfonyloxy)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(4-methylphenyl)sulfonyloxy-1,4-dioxobutan-2-yl] ester IUPAC Name: [3-(4-methylphenyl)sulfonyloxy-1,4-dioxobutan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-formyl-3-keto-2-tosyloxy-propyl) ester Formula: C18H18O8S2 MolecularWeight: 426.46072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O8S2/c1-13-3-7-15(8-4-13)27(21,22)25-17(11-19)18(12-20)26-28(23,24)16-9-5-14(2)6-10-16/h3-12,17-18H,1-2H3