3-acetamido-2,4,6-tris(iodanyl)-5-(methylcarbamoyl)benzoate

Systemtic Name: 3-acetamido-2,4,6-tris(iodanyl)-5-(methylcarbamoyl)benzoate Openeye Name: 3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoate CAS Name: 3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoate IUPAC Name: 3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoate Traditional Name: 3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoate Formula: C11H8I3N2O4- MolecularWeight: 612.90563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)C(=O)NC)I

Isomeric SMILES

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)C(=O)NC)I

InChI

InChI=1S/C11H9I3N2O4/c1-3(17)16-9-7(13)4(10(18)15-2)6(12)5(8(9)14)11(19)20/h1-2H3,(H,15,18)(H,16,17)(H,19,20)/p-1