1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate; tris(4-dimethylaminophenyl)sulfanium

Systemtic Name: 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate; tris(4-dimethylaminophenyl)sulfanium Openeye Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate; tris(4-dimethylaminophenyl)sulfonium CAS Name: 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate; tris(4-dimethylaminophenyl)sulfonium IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate; tris(4-dimethylaminophenyl)sulfanium Traditional Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate; tris(4-dimethylaminophenyl)sulfonium Formula: C28H30F9N3O3S2 MolecularWeight: 691.671729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N3S.C4HF9O3S/c1-25(2)19-7-13-22(14-8-19)28(23-15-9-20(10-16-23)26(3)4)24-17-11-21(12-18-24)27(5)6;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h7-18H,1-6H3;(H,14,15,16)/q+1;/p-1