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Substance Name: Metrizoate magnesium
RN: 20968-37-0
UNII: V717MS5D5B
InChIKey: QGZYHVVYXBFUSE-UHFFFAOYSA-L

Molecular Formula

  • C12-H11-I3-N2-O4.1/2Mg

Molecular Weight

  • 1278.147
 
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Names and Synonyms

Results Name

  • Metrizoate magnesium

Name of Substance

  • Metrizoate magnesium

Synonyms

  • EINECS 244-130-8
  • Magnesium metrizoate
  • Metrizoate magnesium
  • UNII-V717MS5D5B

Systematic Name

  • Magnesium 3-(acetylamino)-5-(acetylmethylamino)-2,4,6-triiodobenzoate (1:2)

Registry Numbers

CAS Registry Number

  • 20968-37-0

FDA UNII

  • V717MS5D5B

System Generated Number

  • 0020968370

Molecular Formulas

Molecular Formula

  • C12-H11-I3-N2-O4.1/2Mg

Molecular Formula Fragments

  • C12-H11-I3-N2-O4
  • COMPONENT
  • Mg

Structure Descriptors

InChI

1S/2C12H11I3N2O4.Mg/c2*1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19;/h2*1-3H3,(H,16,18)(H,20,21);/q;;+2/p-2

InChIKey

QGZYHVVYXBFUSE-UHFFFAOYSA-L

Smiles

[Mg+2].CN(C(=O)C)c1c(I)c(NC(=O)C)c(I)c(C(=O)[O-])c1I.CN(C(=O)C)c2c(I)c(NC(=O)C)c(I)c(C(=O)[O-])c2I