Oragrafin
PubChem Notes:
Ipodate Ionic monomeric contrast media. Usually the sodium or calcium salts are used for examination of the gall bladder and biliary tract. (From Martindale, The Extra Pharmacopoeia, 30th ed, p704)
Molecular Formula:
C
12
H
13
I
3
N
2
O
2
InChI:
InChI=1/C12H13I3N2O2/c1-17(2)6-16-12-9(14)5-8(13)7(11(12)15)3-4-10(18)19/h5-6H,3-4H2,1-2H3,(H,18,19)/b16-6+/f/h18H
InChIKey:
InChIKey=YQNFBOJPTAXAKV-HFSORDEADQ
SMILES:
CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)O)I)I
Names:
Bilimin acid
Bilopten
BRN 2220636
EINECS 226-992-7
HSDB 3347
Iopodic acid
IPODATE
Ipodic acid
Oragrafin
2,4,6-Triiodo-3-((dimethylaminomethylene)amino)hydrocinnamic acid
3-[3-(dimethylaminomethylideneamino)-2,4,6-triiodo-phenyl]propanoic acid
Registries:
PubChem CID 5241
PubChem ID 164488