3,5-bis(trifluoromethyl)benzenesulfonate; tetramethylazanium

Systemtic Name: 3,5-bis(trifluoromethyl)benzenesulfonate; tetramethylazanium Openeye Name: 3,5-bis(trifluoromethyl)benzenesulfonate; tetramethylammonium CAS Name: 3,5-bis(trifluoromethyl)benzenesulfonate; tetramethylammonium IUPAC Name: 3,5-bis(trifluoromethyl)benzenesulfonate; tetramethylazanium Traditional Name: 3,5-bis(trifluoromethyl)besylate; tetramethylammonium Formula: C12H15F6NO3S MolecularWeight: 367.307819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C.C1=C(C=C(C=C1C(F)(F)F)S(=O)(=O)[O-])C(F)(F)F

Isomeric SMILES

C[N+](C)(C)C.C1=C(C=C(C=C1C(F)(F)F)S(=O)(=O)[O-])C(F)(F)F

InChI

InChI=1S/C8H4F6O3S.C4H12N/c9-7(10,11)4-1-5(8(12,13)14)3-6(2-4)18(15,16)17;1-5(2,3)4/h1-3H,(H,15,16,17);1-4H3/q;+1/p-1