[6-(4-methylphenyl)sulfonyloxy-2-bicyclo[3.3.1]nonanyl] 4-methylbenzenesulfonate

Systemtic Name: [6-(4-methylphenyl)sulfonyloxy-2-bicyclo[3.3.1]nonanyl] 4-methylbenzenesulfonate Openeye Name: [6-(p-tolylsulfonyloxy)-2-bicyclo[3.3.1]nonanyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-(4-methylphenyl)sulfonyloxy-2-bicyclo[3.3.1]nonanyl] ester IUPAC Name: [6-(4-methylphenyl)sulfonyloxy-2-bicyclo[3.3.1]nonanyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-tosyloxy-2-bicyclo[3.3.1]nonanyl) ester Formula: C23H28O6S2 MolecularWeight: 464.59482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3CC2CCC3OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3CC2CCC3OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H28O6S2/c1-16-3-9-20(10-4-16)30(24,25)28-22-13-7-19-15-18(22)8-14-23(19)29-31(26,27)21-11-5-17(2)6-12-21/h3-6,9-12,18-19,22-23H,7-8,13-15H2,1-2H3