2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid

Systemtic Name: 2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid Openeye Name: 2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid CAS Name: 2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid IUPAC Name: 2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid Traditional Name: 2-iodyl-3,5-bis(trifluoromethyl)terephthalic acid Formula: C10H3F6IO6 MolecularWeight: 460.022109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1C(F)(F)F)C(=O)O)C(F)(F)F)I(=O)=O)C(=O)O

Isomeric SMILES

C1=C(C(=C(C(=C1C(F)(F)F)C(=O)O)C(F)(F)F)I(=O)=O)C(=O)O

InChI

InChI=1S/C10H3F6IO6/c11-9(12,13)3-1-2(7(18)19)6(17(22)23)5(10(14,15)16)4(3)8(20)21/h1H,(H,18,19)(H,20,21)