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Substance Name: Acetic acid, 2-(2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)ethoxy)-2-phenyl-, sodium salt
RN: 102585-59-1
InChIKey: ICYHIFMHVRGJOD-UHFFFAOYSA-M

Molecular Formula

  • C19-H17-I3-N-O5.Na

Molecular Weight

  • 743.035
 
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Names and Synonyms

Synonym

  • 2-(2-(3-(N-Methylacetamido)-2,4,6-triiodophenoxy)ethoxy)-2-phenylacetic acid sodium salt

Systematic Name

  • Acetic acid, 2-(2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)ethoxy)-2-phenyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 102585-59-1

System Generated Number

  • 0102585591

Molecular Formulas

Molecular Formula

  • C19-H17-I3-N-O5.Na

Molecular Formula Fragments

  • C19-H17-I3-N-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C19H18I3NO5.Na/c1-11(24)23(2)16-13(20)10-14(21)18(15(16)22)28-9-8-27-17(19(25)26)12-6-4-3-5-7-12;/h3-7,10,17H,8-9H2,1-2H3,(H,25,26);/q;+1/p-1

InChIKey

ICYHIFMHVRGJOD-UHFFFAOYSA-M

Smiles

c1(c(c(c(I)cc1I)OCCO[C@@H](c1ccccc1)C(=O)[O-])I)N(C(C)=O)C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 525mg/kg (525mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.
mouse LD50 oral 1660mg/kg (1660mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.