N,N-dimethylmethanamide; 5-(ethanoylcarbamoyl)-2,3,4-tris(iodanyl)benzoic acid

Systemtic Name: N,N-dimethylmethanamide; 5-(ethanoylcarbamoyl)-2,3,4-tris(iodanyl)benzoic acid Openeye Name: 5-(acetylcarbamoyl)-2,3,4-triiodo-benzoic acid; N,N-dimethylformamide CAS Name: 5-[acetamido(oxo)methyl]-2,3,4-triiodobenzoic acid; N,N-dimethylformamide IUPAC Name: 5-(acetylcarbamoyl)-2,3,4-triiodobenzoic acid; N,N-dimethylformamide Traditional Name: 5-(acetylcarbamoyl)-2,3,4-triiodo-benzoic acid; N,N-dimethylformamide Formula: C13H13I3N2O5 MolecularWeight: 657.96613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=O)C1=CC(=C(C(=C1I)I)I)C(=O)O.CN(C)C=O

Isomeric SMILES

CC(=O)NC(=O)C1=CC(=C(C(=C1I)I)I)C(=O)O.CN(C)C=O

InChI

InChI=1S/C10H6I3NO4.C3H7NO/c1-3(15)14-9(16)4-2-5(10(17)18)7(12)8(13)6(4)11;1-4(2)3-5/h2H,1H3,(H,17,18)(H,14,15,16);3H,1-2H3