3-acetamido-N-[2,3-bis(oxidanyl)propyl]-5-[2-hydroxyethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzamide

Systemtic Name: 3-acetamido-N-[2,3-bis(oxidanyl)propyl]-5-[2-hydroxyethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzamide Openeye Name: 3-acetamido-N-(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodo-benzamide CAS Name: 3-acetamido-N-(2,3-dihydroxypropyl)-5-[2-hydroxyethyl-(2-hydroxy-1-oxoethyl)amino]-2,4,6-triiodobenzamide IUPAC Name: 3-acetamido-N-(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodobenzamide Traditional Name: 3-acetamido-N-glyceryl-5-[glycoloyl(2-hydroxyethyl)amino]-2,4,6-triiodo-benzamide Formula: C16H20I3N3O7 MolecularWeight: 747.05931

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)N(CCO)C(=O)CO)I

Isomeric SMILES

CC(=O)NC1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)N(CCO)C(=O)CO)I

InChI

InChI=1S/C16H20I3N3O7/c1-7(26)21-14-11(17)10(16(29)20-4-8(27)5-24)12(18)15(13(14)19)22(2-3-23)9(28)6-25/h8,23-25,27H,2-6H2,1H3,(H,20,29)(H,21,26)