2,4,6-tris(iodanyl)-5-octoxy-benzene-1,3-dicarboxylic acid

Systemtic Name: 2,4,6-tris(iodanyl)-5-octoxy-benzene-1,3-dicarboxylic acid Openeye Name: 2,4,6-triiodo-5-octoxy-benzene-1,3-dicarboxylic acid CAS Name: 2,4,6-triiodo-5-octoxybenzene-1,3-dicarboxylic acid IUPAC Name: 2,4,6-triiodo-5-octoxybenzene-1,3-dicarboxylic acid Traditional Name: 2,4,6-triiodo-5-octoxy-isophthalic acid Formula: C16H19I3O5 MolecularWeight: 672.03247

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

InChI

InChI=1S/C16H19I3O5/c1-2-3-4-5-6-7-8-24-14-12(18)9(15(20)21)11(17)10(13(14)19)16(22)23/h2-8H2,1H3,(H,20,21)(H,22,23)