(4-cyanonaphthalen-1-yl)-dimethyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: (4-cyanonaphthalen-1-yl)-dimethyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: (4-cyano-1-naphthyl)-dimethyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: (4-cyano-1-naphthalenyl)-dimethylsulfonium; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: (4-cyanonaphthalen-1-yl)-dimethylsulfanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: (4-cyano-1-naphthyl)-dimethyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C17H12F9NO3S2 MolecularWeight: 513.397709

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)C1=CC=C(C2=CC=CC=C21)C#N.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

Isomeric SMILES

C[S+](C)C1=CC=C(C2=CC=CC=C21)C#N.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

InChI

InChI=1S/C13H12NS.C4HF9O3S/c1-15(2)13-8-7-10(9-14)11-5-3-4-6-12(11)13;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h3-8H,1-2H3;(H,14,15,16)/q+1;/p-1