[2-[4-(trifluoromethyl)phenyl]cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [2-[4-(trifluoromethyl)phenyl]cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [2-[4-(trifluoromethyl)phenyl]cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[4-(trifluoromethyl)phenyl]cyclohexyl] ester IUPAC Name: [2-[4-(trifluoromethyl)phenyl]cyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[4-(trifluoromethyl)phenyl]cyclohexyl] ester Formula: C20H21F3O3S MolecularWeight: 398.43915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H21F3O3S/c1-14-6-12-17(13-7-14)27(24,25)26-19-5-3-2-4-18(19)15-8-10-16(11-9-15)20(21,22)23/h6-13,18-19H,2-5H2,1H3