N1,N3-bis[1,3-bis(oxidanyl)propan-2-yl]-2,4,6-tris(iodanyl)-5-oxidanyl-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[1,3-bis(oxidanyl)propan-2-yl]-2,4,6-tris(iodanyl)-5-oxidanyl-benzene-1,3-dicarboxamide Openeye Name: 5-hydroxy-N1,N3-bis[2-hydroxy-1-(hydroxymethyl)ethyl]-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(1,3-dihydroxypropan-2-yl)-5-hydroxy-2,4,6-triiodobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(1,3-dihydroxypropan-2-yl)-5-hydroxy-2,4,6-triiodobenzene-1,3-dicarboxamide Traditional Name: 5-hydroxy-N,N'-bis(2-hydroxy-1-methylol-ethyl)-2,4,6-triiodo-isophthalamide Formula: C14H17I3N2O7 MolecularWeight: 706.00739

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)NC(=O)C1=C(C(=C(C(=C1I)O)I)C(=O)NC(CO)CO)I)O

Isomeric SMILES

C(C(CO)NC(=O)C1=C(C(=C(C(=C1I)O)I)C(=O)NC(CO)CO)I)O

InChI

InChI=1S/C14H17I3N2O7/c15-9-7(13(25)18-5(1-20)2-21)10(16)12(24)11(17)8(9)14(26)19-6(3-22)4-23/h5-6,20-24H,1-4H2,(H,18,25)(H,19,26)