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

Systemtic Name: 5-[2-hydroxyethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)-N3,N3-bis[1,4,5-tris(oxidanyl)pentan-2-yl]benzene-1,3-dicarboxamide Openeye Name: N3,N3-bis[3,4-dihydroxy-1-(hydroxymethyl)butyl]-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: 5-[2-hydroxyethyl-(2-hydroxy-1-oxoethyl)amino]-2,4,6-triiodo-N3,N3-bis(1,4,5-trihydroxypentan-2-yl)benzene-1,3-dicarboxamide IUPAC Name: 5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodo-3-N,3-N-bis(1,4,5-trihydroxypentan-2-yl)benzene-1,3-dicarboxamide Traditional Name: N',N'-bis(3,4-dihydroxy-1-methylol-butyl)-5-[glycoloyl(2-hydroxyethyl)amino]-2,4,6-triiodo-isophthalamide Formula: C22H32I3N3O11 MolecularWeight: 895.21639

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32I3N3O11/c23-17-15(21(26)38)18(24)20(27(1-2-29)14(37)9-34)19(25)16(17)22(39)28(10(5-30)3-12(35)7-32)11(6-31)4-13(36)8-33/h10-13,29-36H,1-9H2,(H2,26,38)