5-[4-iodanyl-2-(trifluoromethyl)phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-iodanyl-2-(trifluoromethyl)phenyl]furan-2-carboxylic acid Openeye Name: 5-[4-iodo-2-(trifluoromethyl)phenyl]furan-2-carboxylic acid CAS Name: 5-[4-iodo-2-(trifluoromethyl)phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-iodo-2-(trifluoromethyl)phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-iodo-2-(trifluoromethyl)phenyl]-2-furoic acid Formula: C12H6F3IO3 MolecularWeight: 382.07392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)C(F)(F)F)C2=CC=C(O2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1I)C(F)(F)F)C2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H6F3IO3/c13-12(14,15)8-5-6(16)1-2-7(8)9-3-4-10(19-9)11(17)18/h1-5H,(H,17,18)