5-[[2-[[[3,5-bis[bis(2-hydroxyethyl)carbamoyl]-2,4-bis(iodanyl)phenoxy]-(2-iodanylethanoyl)amino]methyl]-2-(hydroxymethyl)-3-oxidanyl-propyl]-(2-iodanylethanoyl)amino]oxy-N1,N1,N3,N3-tetrakis(2-hydroxyethyl)-2,4-bis(iodanyl)benzene-1,3-dicarboxamide

Systemtic Name: 5-[[2-[[[3,5-bis[bis(2-hydroxyethyl)carbamoyl]-2,4-bis(iodanyl)phenoxy]-(2-iodanylethanoyl)amino]methyl]-2-(hydroxymethyl)-3-oxidanyl-propyl]-(2-iodanylethanoyl)amino]oxy-N1,N1,N3,N3-tetrakis(2-hydroxyethyl)-2,4-bis(iodanyl)benzene-1,3-dicarboxamide Openeye Name: 5-[[2-[[[3,5-bis[bis(2-hydroxyethyl)carbamoyl]-2,4-diiodo-phenoxy]-(2-iodoacetyl)amino]methyl]-3-hydroxy-2-(hydroxymethyl)propyl]-(2-iodoacetyl)amino]oxy-N1,N1,N3,N3-tetrakis(2-hydroxyethyl)-2,4-diiodo-benzene-1,3-dicarboxamide CAS Name: 5-[[2-[[[3,5-bis[[bis(2-hydroxyethyl)amino]-oxomethyl]-2,4-diiodophenoxy]-(2-iodo-1-oxoethyl)amino]methyl]-3-hydroxy-2-(hydroxymethyl)propyl]-(2-iodo-1-oxoethyl)amino]oxy-N1,N1,N3,N3-tetrakis(2-hydroxyethyl)-2,4-diiodobenzene-1,3-dicarboxamide IUPAC Name: 5-[[2-[[[3,5-bis[bis(2-hydroxyethyl)carbamoyl]-2,4-diiodophenoxy]-(2-iodoacetyl)amino]methyl]-3-hydroxy-2-(hydroxymethyl)propyl]-(2-iodoacetyl)amino]oxy-1-N,1-N,3-N,3-N-tetrakis(2-hydroxyethyl)-2,4-diiodobenzene-1,3-dicarboxamide Traditional Name: 5-[[2-[[[3,5-bis[bis(2-hydroxyethyl)carbamoyl]-2,4-diiodo-phenoxy]-(2-iodoacetyl)amino]methyl]-3-hydroxy-2-methylol-propyl]-(2-iodoacetyl)amino]oxy-N,N,N',N'-tetrakis(2-hydroxyethyl)-2,4-diiodo-isophthalamide Formula: C41H56I6N6O18 MolecularWeight: 1682.33956

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1ON(CC(CN(C(=O)CI)OC2=C(C(=C(C(=C2)C(=O)N(CCO)CCO)I)C(=O)N(CCO)CCO)I)(CO)CO)C(=O)CI)I)C(=O)N(CCO)CCO)I)C(=O)N(CCO)CCO

Isomeric SMILES

C1=C(C(=C(C(=C1ON(CC(CN(C(=O)CI)OC2=C(C(=C(C(=C2)C(=O)N(CCO)CCO)I)C(=O)N(CCO)CCO)I)(CO)CO)C(=O)CI)I)C(=O)N(CCO)CCO)I)C(=O)N(CCO)CCO

InChI

InChI=1S/C41H56I6N6O18/c42-19-29(64)52(70-27-17-25(37(66)48(1-9-54)2-10-55)33(44)31(35(27)46)39(68)50(5-13-58)6-14-59)21-41(23-62,24-63)22-53(30(65)20-43)71-28-18-26(38(67)49(3-11-56)4-12-57)34(45)32(36(28)47)40(69)51(7-15-60)8-16-61/h17-18,54-63H,1-16,19-24H2