3-cyano-2,4,6-tris(iodanyl)-5-(methylcarbamoyl)benzoic acid

Systemtic Name: 3-cyano-2,4,6-tris(iodanyl)-5-(methylcarbamoyl)benzoic acid Openeye Name: 3-cyano-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid CAS Name: 3-cyano-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid IUPAC Name: 3-cyano-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid Traditional Name: 3-cyano-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid Formula: C10H5I3N2O3 MolecularWeight: 581.87171

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(C(=C(C(=C1I)C#N)I)C(=O)O)I

Isomeric SMILES

CNC(=O)C1=C(C(=C(C(=C1I)C#N)I)C(=O)O)I

InChI

InChI=1S/C10H5I3N2O3/c1-15-9(16)4-6(11)3(2-14)7(12)5(8(4)13)10(17)18/h1H3,(H,15,16)(H,17,18)