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

Systemtic Name: 2,4,6-tris(iodanyl)-5-(propanoylamino)benzene-1,3-dicarboxylic acid Openeye Name: 2,4,6-triiodo-5-(propanoylamino)benzene-1,3-dicarboxylic acid CAS Name: 2,4,6-triiodo-5-(1-oxopropylamino)benzene-1,3-dicarboxylic acid IUPAC Name: 2,4,6-triiodo-5-(propanoylamino)benzene-1,3-dicarboxylic acid Traditional Name: 2,4,6-triiodo-5-propionamido-isophthalic acid Formula: C11H8I3NO5 MolecularWeight: 614.89833

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

Isomeric SMILES

CCC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

InChI

InChI=1S/C11H8I3NO5/c1-2-3(16)15-9-7(13)4(10(17)18)6(12)5(8(9)14)11(19)20/h2H2,1H3,(H,15,16)(H,17,18)(H,19,20)