3-acetamido-2,4,6-tris(iodanyl)-N-methyl-5-[2-(methylamino)-1-oxidanyl-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-acetamido-2,4,6-tris(iodanyl)-N-methyl-5-[2-(methylamino)-1-oxidanyl-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-acetamido-5-[1-hydroxy-2-(methylamino)-2-oxo-ethyl]-2,4,6-triiodo-N-methyl-benzamide CAS Name: 3-acetamido-5-[1-hydroxy-2-(methylamino)-2-oxoethyl]-2,4,6-triiodo-N-methylbenzamide IUPAC Name: 3-acetamido-5-[1-hydroxy-2-(methylamino)-2-oxoethyl]-2,4,6-triiodo-N-methylbenzamide Traditional Name: 3-acetamido-5-[1-hydroxy-2-keto-2-(methylamino)ethyl]-2,4,6-triiodo-N-methyl-benzamide Formula: C13H14I3N3O4 MolecularWeight: 656.98137

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C(=C1I)C(C(=O)NC)O)I)C(=O)NC)I

Isomeric SMILES

CC(=O)NC1=C(C(=C(C(=C1I)C(C(=O)NC)O)I)C(=O)NC)I

InChI

InChI=1S/C13H14I3N3O4/c1-4(20)19-10-8(15)5(11(21)13(23)18-3)7(14)6(9(10)16)12(22)17-2/h11,21H,1-3H3,(H,17,22)(H,18,23)(H,19,20)