sodium 3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2-phenyl-propanoate

Systemtic Name: sodium 3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2-phenyl-propanoate Openeye Name: sodium 3-(4-hydroxy-3,5-diiodo-phenyl)-2-phenyl-propanoate CAS Name: sodium 3-(4-hydroxy-3,5-diiodophenyl)-2-phenylpropanoate IUPAC Name: sodium 3-(4-hydroxy-3,5-diiodophenyl)-2-phenylpropanoate Traditional Name: sodium 3-(4-hydroxy-3,5-diiodo-phenyl)-2-phenyl-propionate Formula: C15H11I2NaO3 MolecularWeight: 516.04475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2=CC(=C(C(=C2)I)O)I)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(CC2=CC(=C(C(=C2)I)O)I)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H12I2O3.Na/c16-12-7-9(8-13(17)14(12)18)6-11(15(19)20)10-4-2-1-3-5-10;/h1-5,7-8,11,18H,6H2,(H,19,20);/q;+1/p-1