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Substance Name: Acetic acid, 2-(2-(3-(N-ethylacetamido)-2,4,6-triiodophenoxy)ethoxy)-2-phenyl-, sodium salt
RN: 102585-52-4
InChIKey: ZCMPPFAMGUACSR-UHFFFAOYSA-M

Molecular Formula

  • C20-H19-I3-N-O5.Na

Molecular Weight

  • 757.062
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 102585-52-4

System Generated Number

  • 0102585524

Molecular Formulas

Molecular Formula

  • C20-H19-I3-N-O5.Na

Molecular Formula Fragments

  • C20-H19-I3-N-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H20I3NO5.Na/c1-3-24(12(2)25)17-14(21)11-15(22)19(16(17)23)29-10-9-28-18(20(26)27)13-7-5-4-6-8-13;/h4-8,11,18H,3,9-10H2,1-2H3,(H,26,27);/q;+1/p-1

InChIKey

ZCMPPFAMGUACSR-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 405mg/kg (405mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.
mouse LD50 oral 1600mg/kg (1600mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.