[2,3,4,5,6-pentakis(fluoranyl)phenyl] 4-cyanobenzenesulfonate

Systemtic Name: [2,3,4,5,6-pentakis(fluoranyl)phenyl] 4-cyanobenzenesulfonate Openeye Name: (2,3,4,5,6-pentafluorophenyl) 4-cyanobenzenesulfonate CAS Name: 4-cyanobenzenesulfonic acid (2,3,4,5,6-pentafluorophenyl) ester IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 4-cyanobenzenesulfonate Traditional Name: 4-cyanobenzenesulfonic acid (2,3,4,5,6-pentafluorophenyl) ester Formula: C13H4F5NO3S MolecularWeight: 349.232776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

InChI

InChI=1S/C13H4F5NO3S/c14-8-9(15)11(17)13(12(18)10(8)16)22-23(20,21)7-3-1-6(5-19)2-4-7/h1-4H