[2,2,2-tris(fluoranyl)-1-(4-methylphenyl)ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2,2,2-tris(fluoranyl)-1-(4-methylphenyl)ethyl] 4-methylbenzenesulfonate Openeye Name: [2,2,2-trifluoro-1-(p-tolyl)ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,2,2-trifluoro-1-(4-methylphenyl)ethyl] ester IUPAC Name: [2,2,2-trifluoro-1-(4-methylphenyl)ethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,2,2-trifluoro-1-(p-tolyl)ethyl] ester Formula: C16H15F3O3S MolecularWeight: 344.34871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(F)(F)F)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C(F)(F)F)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H15F3O3S/c1-11-3-7-13(8-4-11)15(16(17,18)19)22-23(20,21)14-9-5-12(2)6-10-14/h3-10,15H,1-2H3