bis[4-(trifluoromethyl)phenyl]iodanium; 2-dodecylbenzenesulfonate

Systemtic Name: bis[4-(trifluoromethyl)phenyl]iodanium; 2-dodecylbenzenesulfonate Openeye Name: bis[4-(trifluoromethyl)phenyl]iodonium; 2-dodecylbenzenesulfonate CAS Name: bis[4-(trifluoromethyl)phenyl]iodonium; 2-dodecylbenzenesulfonate IUPAC Name: bis[4-(trifluoromethyl)phenyl]iodanium; 2-dodecylbenzenesulfonate Traditional Name: bis[4-(trifluoromethyl)phenyl]iodonium; 2-laurylbesylate Formula: C32H37F6IO3S MolecularWeight: 742.594269

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC(=CC=C1C(F)(F)F)[I+]C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC(=CC=C1C(F)(F)F)[I+]C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C18H30O3S.C14H8F6I/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;15-13(16,17)9-1-5-11(6-2-9)21-12-7-3-10(4-8-12)14(18,19)20/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);1-8H/q;+1/p-1