4-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-3,5-bis(iodanyl)benzoic acid

Systemtic Name: 4-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-3,5-bis(iodanyl)benzoic acid Openeye Name: 4-[(4-bromo-2-fluoro-phenyl)methoxy]-3,5-diiodo-benzoic acid CAS Name: 4-[(4-bromo-2-fluorophenyl)methoxy]-3,5-diiodobenzoic acid IUPAC Name: 4-[(4-bromo-2-fluorophenyl)methoxy]-3,5-diiodobenzoic acid Traditional Name: 4-(4-bromo-2-fluoro-benzyl)oxy-3,5-diiodo-benzoic acid Formula: C14H8BrFI2O3 MolecularWeight: 576.922863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)COC2=C(C=C(C=C2I)C(=O)O)I

Isomeric SMILES

C1=CC(=C(C=C1Br)F)COC2=C(C=C(C=C2I)C(=O)O)I

InChI

InChI=1S/C14H8BrFI2O3/c15-9-2-1-7(10(16)5-9)6-21-13-11(17)3-8(14(19)20)4-12(13)18/h1-5H,6H2,(H,19,20)