[2,6-bis(trifluoromethyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2,6-bis(trifluoromethyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-bis(trifluoromethyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,6-bis(trifluoromethyl)phenyl] ester IUPAC Name: [2,6-bis(trifluoromethyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,6-bis(trifluoromethyl)phenyl] ester Formula: C15H10F6O3S MolecularWeight: 384.293519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H10F6O3S/c1-9-5-7-10(8-6-9)25(22,23)24-13-11(14(16,17)18)3-2-4-12(13)15(19,20)21/h2-8H,1H3