2,3,4,5,6-pentakis(fluoranyl)benzoate; triphenylsulfanium

Systemtic Name: 2,3,4,5,6-pentakis(fluoranyl)benzoate; triphenylsulfanium Openeye Name: 2,3,4,5,6-pentafluorobenzoate; triphenylsulfonium CAS Name: 2,3,4,5,6-pentafluorobenzoate; triphenylsulfonium IUPAC Name: 2,3,4,5,6-pentafluorobenzoate; triphenylsulfanium Traditional Name: 2,3,4,5,6-pentafluorobenzoate; triphenylsulfonium Formula: C25H15F5O2S MolecularWeight: 474.442416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)[O-]

InChI

InChI=1S/C18H15S.C7HF5O2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h1-15H;(H,13,14)/q+1;/p-1