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

Systemtic Name: N3,N3-bis[2,3-bis(oxidanyl)propyl]-2,4,6-tris(iodanyl)-5-[(3-methoxy-2-oxidanyl-propyl)-(2-oxidanylethanoyl)amino]benzene-1,3-dicarboxamide Openeye Name: N3,N3-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxy-3-methoxy-propyl)amino]-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: N3,N3-bis(2,3-dihydroxypropyl)-5-[(2-hydroxy-3-methoxypropyl)-(2-hydroxy-1-oxoethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide IUPAC Name: 3-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxy-3-methoxypropyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide Traditional Name: N',N'-diglyceryl-5-[glycoloyl-(2-hydroxy-3-methoxy-propyl)amino]-2,4,6-triiodo-isophthalamide Formula: C20H28I3N3O10 MolecularWeight: 851.16383

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CN(C1=C(C(=C(C(=C1I)C(=O)N(CC(CO)O)CC(CO)O)I)C(=O)N)I)C(=O)CO)O

Isomeric SMILES

COCC(CN(C1=C(C(=C(C(=C1I)C(=O)N(CC(CO)O)CC(CO)O)I)C(=O)N)I)C(=O)CO)O

InChI

InChI=1S/C20H28I3N3O10/c1-36-8-11(32)4-26(12(33)7-29)18-16(22)13(19(24)34)15(21)14(17(18)23)20(35)25(2-9(30)5-27)3-10(31)6-28/h9-11,27-32H,2-8H2,1H3,(H2,24,34)