2-dimethylsulfonioethyl-hexadecyl-dimethyl-azanium; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 2-dimethylsulfonioethyl-hexadecyl-dimethyl-azanium; tris(fluoranyl)methanesulfonic acid Openeye Name: 2-dimethylsulfonioethyl-hexadecyl-dimethyl-ammonium; trifluoromethanesulfonic acid CAS Name: 2-dimethylsulfonioethyl-hexadecyl-dimethylammonium; trifluoromethanesulfonic acid IUPAC Name: 2-dimethylsulfonioethyl-hexadecyl-dimethylazanium; trifluoromethanesulfonic acid Traditional Name: cetyl-(2-dimethylsulfonioethyl)-dimethyl-ammonium; triflic acid Formula: C23H50F3NO3S2+2 MolecularWeight: 509.77321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC[S+](C)C.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC[S+](C)C.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C22H49NS.CHF3O3S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22-24(4)5;2-1(3,4)8(5,6)7/h6-22H2,1-5H3;(H,5,6,7)/q+2;