naphthalen-1-yl(diphenyl)sulfanium; 4-(trifluoromethyl)benzenesulfonate

Systemtic Name: naphthalen-1-yl(diphenyl)sulfanium; 4-(trifluoromethyl)benzenesulfonate Openeye Name: 1-naphthyl(diphenyl)sulfonium; 4-(trifluoromethyl)benzenesulfonate CAS Name: 1-naphthalenyl(diphenyl)sulfonium; 4-(trifluoromethyl)benzenesulfonate IUPAC Name: naphthalen-1-yl(diphenyl)sulfanium; 4-(trifluoromethyl)benzenesulfonate Traditional Name: 1-naphthyl(diphenyl)sulfonium; 4-(trifluoromethyl)besylate Formula: C29H21F3O3S2 MolecularWeight: 538.60045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43.C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43.C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)[O-]

InChI

InChI=1S/C22H17S.C7H5F3O3S/c1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;8-7(9,10)5-1-3-6(4-2-5)14(11,12)13/h1-17H;1-4H,(H,11,12,13)/q+1;/p-1