SpectraBase Spectrum ID |
4C9vbGfbLbU |
Name |
Iopentol |
CAS Registry Number |
89797-00-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H28I3N3O9 |
InChI |
InChI=1S/C20H28I3N3O9/c1-9(29)26(5-12(32)8-35-2)18-16(22)13(19(33)24-3-10(30)6-27)15(21)14(17(18)23)20(34)25-4-11(31)7-28/h10-12,27-28,30-32H,3-8H2,1-2H3,(H,24,33)(H,25,34) |
InChIKey |
IUNJANQVIJDFTQ-UHFFFAOYSA-N |
Molecular Weight |
835.169 g/mol |
SMILES |
N(C(c1c(c(N(CC(O)COC)C(=O)C)c(c(c1I)C(NCC(CO)O)=O)I)I)=O)CC(CO)O |
SPLASH |
splash10-0udi-0490000000-d825057d61295ff70f99 |
Source of Spectrum |
CJ-0-18-3508 |
Synonyms |
5-[acetyl-(2-hydroxy-3-methoxy-propyl)amino]-N,N'-diglyceryl-2,4,6-triiodo-isophthalamide
5-[acetyl-(2-hydroxy-3-methoxy-propyl)amino]-N1,N3-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide
5-[acetyl-(2-hydroxy-3-methoxypropyl)amino]-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
N1,N3-bis[2,3-bis(oxidanyl)propyl]-5-[ethanoyl-(3-methoxy-2-oxidanyl-propyl)amino]-2,4,6-tris(iodanyl)benzene-1,3-dicarboxamide |
Wiley ID |
1417582 |