diphenyl-[2,4,6-tri(propan-2-yl)phenyl]sulfanium; 2,3,4,5,6-pentakis(trifluoromethyl)benzenesulfonate

Systemtic Name: diphenyl-[2,4,6-tri(propan-2-yl)phenyl]sulfanium; 2,3,4,5,6-pentakis(trifluoromethyl)benzenesulfonate Openeye Name: diphenyl-(2,4,6-triisopropylphenyl)sulfonium; 2,3,4,5,6-pentakis(trifluoromethyl)benzenesulfonate CAS Name: diphenyl-[2,4,6-tri(propan-2-yl)phenyl]sulfonium; 2,3,4,5,6-pentakis(trifluoromethyl)benzenesulfonate IUPAC Name: diphenyl-[2,4,6-tri(propan-2-yl)phenyl]sulfanium; 2,3,4,5,6-pentakis(trifluoromethyl)benzenesulfonate Traditional Name: diphenyl-(2,4,6-triisopropylphenyl)sulfonium; 2,3,4,5,6-pentakis(trifluoromethyl)besylate Formula: C38H33F15O3S2 MolecularWeight: 886.772868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)[S+](C2=CC=CC=C2)C3=CC=CC=C3)C(C)C.C1(=C(C(=C(C(=C1C(F)(F)F)C(F)(F)F)S(=O)(=O)[O-])C(F)(F)F)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)[S+](C2=CC=CC=C2)C3=CC=CC=C3)C(C)C.C1(=C(C(=C(C(=C1C(F)(F)F)C(F)(F)F)S(=O)(=O)[O-])C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H33S.C11HF15O3S/c1-19(2)22-17-25(20(3)4)27(26(18-22)21(5)6)28(23-13-9-7-10-14-23)24-15-11-8-12-16-24;12-7(13,14)1-2(8(15,16)17)4(10(21,22)23)6(30(27,28)29)5(11(24,25)26)3(1)9(18,19)20/h7-21H,1-6H3;(H,27,28,29)/q+1;/p-1