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

Systemtic Name: disodium 3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2-phenyl-propanoate Openeye Name: disodium 3-(4-hydroxy-3,5-diiodo-phenyl)-2-phenyl-propanoate CAS Name: disodium 3-(4-hydroxy-3,5-diiodophenyl)-2-phenylpropanoate IUPAC Name: disodium 3-(4-hydroxy-3,5-diiodophenyl)-2-phenylpropanoate Traditional Name: disodium 3-(4-hydroxy-3,5-diiodo-phenyl)-2-phenyl-propionate Formula: C15H11I2Na2O3+ MolecularWeight: 539.03452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12I2O3.2Na/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;2*+1/p-1