[4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] methanesulfonate

Systemtic Name: [4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] methanesulfonate Openeye Name: [4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] ester IUPAC Name: [4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[3,3,5-trimethyl-1-(4-methylsulfonyloxyphenyl)cyclohexyl]phenyl] ester Formula: C23H30O6S2 MolecularWeight: 466.6107

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C2=CC=C(C=C2)OS(=O)(=O)C)C3=CC=C(C=C3)OS(=O)(=O)C)(C)C

Isomeric SMILES

CC1CC(CC(C1)(C2=CC=C(C=C2)OS(=O)(=O)C)C3=CC=C(C=C3)OS(=O)(=O)C)(C)C

InChI

InChI=1S/C23H30O6S2/c1-17-14-22(2,3)16-23(15-17,18-6-10-20(11-7-18)28-30(4,24)25)19-8-12-21(13-9-19)29-31(5,26)27/h6-13,17H,14-16H2,1-5H3