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

Systemtic Name: 2,4,6-tris(iodanyl)-5-(2-methoxyethanoylamino)benzene-1,3-dicarboxylic acid Openeye Name: 2,4,6-triiodo-5-[(2-methoxyacetyl)amino]benzene-1,3-dicarboxylic acid CAS Name: 2,4,6-triiodo-5-[(2-methoxy-1-oxoethyl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 2,4,6-triiodo-5-[(2-methoxyacetyl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 2,4,6-triiodo-5-[(2-methoxyacetyl)amino]isophthalic acid Formula: C11H8I3NO6 MolecularWeight: 630.89773

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8I3NO6/c1-21-2-3(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)