[4-[2-[4-(4-methylphenyl)sulfonyloxycyclohexyl]propan-2-yl]cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[2-[4-(4-methylphenyl)sulfonyloxycyclohexyl]propan-2-yl]cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [4-[1-methyl-1-[4-(p-tolylsulfonyloxy)cyclohexyl]ethyl]cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[2-[4-(4-methylphenyl)sulfonyloxycyclohexyl]propan-2-yl]cyclohexyl] ester IUPAC Name: [4-[2-[4-(4-methylphenyl)sulfonyloxycyclohexyl]propan-2-yl]cyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[1-methyl-1-(4-tosyloxycyclohexyl)ethyl]cyclohexyl] ester Formula: C29H40O6S2 MolecularWeight: 548.7543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC(CC2)C(C)(C)C3CCC(CC3)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC(CC2)C(C)(C)C3CCC(CC3)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H40O6S2/c1-21-5-17-27(18-6-21)36(30,31)34-25-13-9-23(10-14-25)29(3,4)24-11-15-26(16-12-24)35-37(32,33)28-19-7-22(2)8-20-28/h5-8,17-20,23-26H,9-16H2,1-4H3