[3,6-bis(iodanyl)-8-(4-methylphenyl)sulfonyloxy-naphthalen-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [3,6-bis(iodanyl)-8-(4-methylphenyl)sulfonyloxy-naphthalen-1-yl] 4-methylbenzenesulfonate Openeye Name: [3,6-diiodo-8-(p-tolylsulfonyloxy)-1-naphthyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,6-diiodo-8-(4-methylphenyl)sulfonyloxy-1-naphthalenyl] ester IUPAC Name: [3,6-diiodo-8-(4-methylphenyl)sulfonyloxynaphthalen-1-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,6-diiodo-8-tosyloxy-1-naphthyl) ester Formula: C24H18I2O6S2 MolecularWeight: 720.33506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC3=CC(=CC(=C32)OS(=O)(=O)C4=CC=C(C=C4)C)I)I

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC3=CC(=CC(=C32)OS(=O)(=O)C4=CC=C(C=C4)C)I)I

InChI

InChI=1S/C24H18I2O6S2/c1-15-3-7-20(8-4-15)33(27,28)31-22-13-18(25)11-17-12-19(26)14-23(24(17)22)32-34(29,30)21-9-5-16(2)6-10-21/h3-14H,1-2H3