4-[2,3,5,6-tetrakis(fluoranyl)-4-nitro-phenoxy]benzoic acid

Systemtic Name: 4-[2,3,5,6-tetrakis(fluoranyl)-4-nitro-phenoxy]benzoic acid Openeye Name: 4-(2,3,5,6-tetrafluoro-4-nitro-phenoxy)benzoic acid CAS Name: 4-(2,3,5,6-tetrafluoro-4-nitrophenoxy)benzoic acid IUPAC Name: 4-(2,3,5,6-tetrafluoro-4-nitrophenoxy)benzoic acid Traditional Name: 4-(2,3,5,6-tetrafluoro-4-nitro-phenoxy)benzoic acid Formula: C13H5F4NO5 MolecularWeight: 331.176113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OC2=C(C(=C(C(=C2F)F)[N+](=O)[O-])F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OC2=C(C(=C(C(=C2F)F)[N+](=O)[O-])F)F

InChI

InChI=1S/C13H5F4NO5/c14-7-9(16)12(10(17)8(15)11(7)18(21)22)23-6-3-1-5(2-4-6)13(19)20/h1-4H,(H,19,20)