Chem
J-GLOBAL ID:200907023403752827
Nikkaji number:J550.711A
Iobitridol
イオビトリドール
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H28 I3 N3 O9
Molecular formula furigana:
C20-H28-I3-N3-O9
Molecular weight:
835.169
InChI:
InChI=1S/C20H28I3N3O9/c1-25(3-10(31)7-29)19(34)12-14(21)13(20(35)26(2)4-11(32)8-30)16(23)17(15(12)22)24-18(33)9(5-27)6-28/h9-11,27-32H,3-8H2,1-2H3,(H,24,33)
InChI key:
YLPBXIKWXNRACS-UHFFFAOYSA-N
SMILES:
CN(CC(O)CO)C(=O)c1c(I)c(NC(=O)C(CO)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I
Systematic name (4):
N,N′-ビス(2,3-ジヒドロキシプロピル)-5-[[3-ヒドロキシ-2-(ヒドロキシメチル)-1-オキソプロピル]アミノ]-2,4,6-トリヨード-N,N′-ジメチル-1,3-ベンゼンジカルボアミド
N,N′-ビス(2,3-ジヒドロキシプロピル)-5-[[2-(ヒドロキシメチル)-3-ヒドロキシ-1-オキソプロピル]アミノ]-2,4,6-トリヨード-N,N′-ジメチル-1,3-ベンゼンジカルボアミド
N1,N3-ビス(2,3-ジヒドロキシプロピル)-5-[3-ヒドロキシ-2-(ヒドロキシメチル)プロパンアミド]-2,4,6-トリヨード-N1,N3-ジメチルベンゼン-1,3-ジカルボキサミド
N1,N3-bis(2,3-dihydroxypropyl)-5-[3-hydroxy-2-(hydroxymethyl)propanamido]-2,4,6-triiodo-N1,N3-dimethylbenzene-1,3-dicarboxamide
Other name (4):
イオビトリドール
Iobitridol
N,N′-Bis(2,3-dihydroxypropyl)-5-[[2-(hydroxymethyl)-3-hydroxy-1-oxopropyl]amino]-2,4,6-triiodo-N,N′-dimethyl-1,3-benzenedicarboxamide
N,N′-Bis(2,3-dihydroxypropyl)-5-[[3-hydroxy-2-(hydroxymethyl)-1-oxopropyl]amino]-2,4,6-triiodo-N,N′-dimethyl-1,3-benzenedicarboxamide
CAS registry number:
136949-58-1
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