4-[2,6-bis(iodanyl)-4-(phenylcarbonyl)phenoxy]sulfonyl-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2,6-bis(iodanyl)-4-(phenylcarbonyl)phenoxy]sulfonyl-2-oxidanyl-benzoic acid Openeye Name: 4-(4-benzoyl-2,6-diiodo-phenoxy)sulfonyl-2-hydroxy-benzoic acid CAS Name: 4-(4-benzoyl-2,6-diiodophenoxy)sulfonyl-2-hydroxybenzoic acid IUPAC Name: 4-(4-benzoyl-2,6-diiodophenoxy)sulfonyl-2-hydroxybenzoic acid Traditional Name: 4-(4-benzoyl-2,6-diiodo-phenoxy)sulfonyl-2-hydroxy-benzoic acid Formula: C20H12I2O7S MolecularWeight: 650.17902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)I)OS(=O)(=O)C3=CC(=C(C=C3)C(=O)O)O)I

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)I)OS(=O)(=O)C3=CC(=C(C=C3)C(=O)O)O)I

InChI

InChI=1S/C20H12I2O7S/c21-15-8-12(18(24)11-4-2-1-3-5-11)9-16(22)19(15)29-30(27,28)13-6-7-14(20(25)26)17(23)10-13/h1-10,23H,(H,25,26)