[(1S,2R)-5-tert-butyl-2-phenyl-cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [(1S,2R)-5-tert-butyl-2-phenyl-cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [(1S,2R)-5-tert-butyl-2-phenyl-cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,2R)-5-tert-butyl-2-phenylcyclohexyl] ester IUPAC Name: [(1S,2R)-5-tert-butyl-2-phenylcyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2R)-5-tert-butyl-2-phenyl-cyclohexyl] ester Formula: C23H30O3S MolecularWeight: 386.5475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(CCC2C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2CC(CC[C@@H]2C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C23H30O3S/c1-17-10-13-20(14-11-17)27(24,25)26-22-16-19(23(2,3)4)12-15-21(22)18-8-6-5-7-9-18/h5-11,13-14,19,21-22H,12,15-16H2,1-4H3/t19?,21-,22+/m1/s1