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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

Isomeric SMILES

CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

InChI

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