4-[2,4,6-tris(iodanyl)-3-oxidanyl-phenoxy]butanoic acid

Systemtic Name: 4-[2,4,6-tris(iodanyl)-3-oxidanyl-phenoxy]butanoic acid Openeye Name: 4-(3-hydroxy-2,4,6-triiodo-phenoxy)butanoic acid CAS Name: 4-(3-hydroxy-2,4,6-triiodophenoxy)butanoic acid IUPAC Name: 4-(3-hydroxy-2,4,6-triiodophenoxy)butanoic acid Traditional Name: 4-(3-hydroxy-2,4,6-triiodo-phenoxy)butyric acid Formula: C10H9I3O4 MolecularWeight: 573.88947

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1I)OCCCC(=O)O)I)O)I

Isomeric SMILES

C1=C(C(=C(C(=C1I)OCCCC(=O)O)I)O)I

InChI

InChI=1S/C10H9I3O4/c11-5-4-6(12)10(8(13)9(5)16)17-3-1-2-7(14)15/h4,16H,1-3H2,(H,14,15)