[(4-methylphenyl)sulfonyloxy-phenyl-$l^{3}-iodanyl] 4-methylbenzenesulfonate

Systemtic Name: [(4-methylphenyl)sulfonyloxy-phenyl-$l^{3}-iodanyl] 4-methylbenzenesulfonate Openeye Name: [phenyl(p-tolylsulfonyloxy)-$l^{3}-iodanyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(4-methylphenyl)sulfonyloxy-phenyl-$l^{3}-iodanyl] ester IUPAC Name: [(4-methylphenyl)sulfonyloxy-phenyl-$l^{3}-iodanyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [phenyl(tosyloxy)iodinanyl] ester Formula: C20H19IO6S2 MolecularWeight: 546.39573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OI(C2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OI(C2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H19IO6S2/c1-16-8-12-19(13-9-16)28(22,23)26-21(18-6-4-3-5-7-18)27-29(24,25)20-14-10-17(2)11-15-20/h3-15H,1-2H3