N1,N3-bis[2,3-bis(oxidanyl)propyl]-5-[hydroxymethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[2,3-bis(oxidanyl)propyl]-5-[hydroxymethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(hydroxymethyl)amino]-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(2,3-dihydroxypropyl)-5-[hydroxymethyl-(2-hydroxy-1-oxoethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(hydroxymethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide Traditional Name: N,N'-diglyceryl-5-[glycoloyl(methylol)amino]-2,4,6-triiodo-isophthalamide Formula: C17H22I3N3O9 MolecularWeight: 793.08469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22I3N3O9/c18-12-10(16(31)21-1-7(28)3-24)13(19)15(23(6-27)9(30)5-26)14(20)11(12)17(32)22-2-8(29)4-25/h7-8,24-29H,1-6H2,(H,21,31)(H,22,32)