[4-[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]phenyl]carbonyl-3-[3-(trifluoromethyl)phenyl]sulfonyloxy-phenyl] 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: [4-[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]phenyl]carbonyl-3-[3-(trifluoromethyl)phenyl]sulfonyloxy-phenyl] 3-(trifluoromethyl)benzenesulfonate Openeye Name: [4-[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]benzoyl]-3-[3-(trifluoromethyl)phenyl]sulfonyloxy-phenyl] 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid [4-[[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]phenyl]-oxomethyl]-3-[3-(trifluoromethyl)phenyl]sulfonyloxyphenyl] ester IUPAC Name: [4-[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]benzoyl]-3-[3-(trifluoromethyl)phenyl]sulfonyloxyphenyl] 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid [4-[2,4-bis[[3-(trifluoromethyl)phenyl]sulfonyloxy]benzoyl]-3-[3-(trifluoromethyl)phenyl]sulfonyloxy-phenyl] ester Formula: C41H22F12O13S4 MolecularWeight: 1078.846418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC(=C(C=C2)C(=O)C3=C(C=C(C=C3)OS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)OS(=O)(=O)C5=CC=CC(=C5)C(F)(F)F)OS(=O)(=O)C6=CC=CC(=C6)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC(=C(C=C2)C(=O)C3=C(C=C(C=C3)OS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)OS(=O)(=O)C5=CC=CC(=C5)C(F)(F)F)OS(=O)(=O)C6=CC=CC(=C6)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C41H22F12O13S4/c42-38(43,44)23-5-1-9-29(17-23)67(55,56)63-27-13-15-33(35(21-27)65-69(59,60)31-11-3-7-25(19-31)40(48,49)50)37(54)34-16-14-28(64-68(57,58)30-10-2-6-24(18-30)39(45,46)47)22-36(34)66-70(61,62)32-12-4-8-26(20-32)41(51,52)53/h1-22H