Metrizoic acid

Metrizoate A diagnostic radiopaque that usually occurs as the sodium salt.

Molecular Formula: C₁₂H₁₁I₃N₂O₄

InChI: InChI=1/C12H11I3N2O4/c1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19/h1-3H3,(H,16,18)(H,20,21)/f/h16,20H

InChIKey: InChIKey=GGGDNPWHMNJRFN-YDDJAZEHCT
SMILES: CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)N(C)C(=O)C)I

Names:
    Acide metrizoique
    Acidum metrizoicum
    BENZOIC ACID, 3-ACETAMIDO-2,4,6-TRIIODO-5-(N-METHYLACETAMIDO)-
    Benzoic acid, 3-(acetylamino)-5-(acetylmethylamino)-2,4,6-triiodo-
    BRN 2822724
    EINECS 217-761-1
    Metrizoate
    Metrizoic acid
    1949-45-7
    3-Acetamido-2,4,6-triiodo-5-N-methylacetamidobenzoic acid
    3-acetamido-5-(acetyl-methyl-amino)-2,4,6-triiodo-benzoic acid

Registries:
    PubChem CID 2528
    PubChem ID 159326