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

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

Systemtic Name:N3-[2,3-bis(oxidanyl)propyl]-5-[2,3-bis(oxidanyl)propyl-ethanoyl-amino]-N1-(2-hydroxyethyl)-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide
Openeye Name:5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide
CAS Name:5-[acetyl(2,3-dihydroxypropyl)amino]-N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
IUPAC Name:5-[acetyl(2,3-dihydroxypropyl)amino]-3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
Traditional Name:5-[acetyl(glyceryl)amino]-N'-glyceryl-N-(2-hydroxyethyl)-2,4,6-triiodo-isophthalamide
Formula: C18H24I3N3O8
MolecularWeight: 791.11187
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H24I3N3O8/c1-8(28)24(5-10(30)7-27)16-14(20)11(17(31)22-2-3-25)13(19)12(15(16)21)18(32)23-4-9(29)6-26/h9-10,25-27,29-30H,2-7H2,1H3,(H,22,31)(H,23,32)


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Name: N3-[2,3-bis(oxidanyl)propyl]-5-[2,3-bis(oxidanyl)propyl-ethanoyl-amino]-N1-(2-hydroxyethyl)-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide

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