3-[3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonyl-1-benzofuran-2-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonyl-1-benzofuran-2-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[3-(4-hydroxy-3,5-diiodo-benzoyl)benzofuran-2-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[3-[(4-hydroxy-3,5-diiodophenyl)-oxomethyl]-2-benzofuranyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[3-(4-hydroxy-3,5-diiodobenzoyl)-1-benzofuran-2-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[3-(4-hydroxy-3,5-diiodo-benzoyl)benzofuran-2-yl]-2,2-dimethyl-propionic acid Formula: C20H16I2O5 MolecularWeight: 590.14698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I)C(=O)O

Isomeric SMILES

CC(C)(CC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I)C(=O)O

InChI

InChI=1S/C20H16I2O5/c1-20(2,19(25)26)9-15-16(11-5-3-4-6-14(11)27-15)17(23)10-7-12(21)18(24)13(22)8-10/h3-8,24H,9H2,1-2H3,(H,25,26)