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Substance Name: Hydrocinnamic acid, p-(3-(N-ethylacetamido)-2,4,6-triiodobenzamido)-
RN: 22708-45-8
InChIKey: XWTKEJJYSRRQPC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-I3-N2-O4

Molecular Weight

  • 732.08
 
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Names and Synonyms

Synonyms

  • Benzenepropanoic acid, 4-((3-(acetylethylamino)-2,4,6-triiodobenzoyl)amino)-
  • beta-(4-(3-(N-Aethyl-acetylamino)-2,4,6-trijod-benzoylamino)-phenyl)-propionsaure
  • beta-(4-(3-(N-Aethyl-acetylamino)-2,4,6-trijod-benzoylamino)-phenyl)-propionsaure [German]
  • BRN 2919599
  • p-(3-(N-Ethylacetamido)-2,4,6-triiodobenzamido)hydrocinnamic acid

Systematic Name

  • Hydrocinnamic acid, p-(3-(N-ethylacetamido)-2,4,6-triiodobenzamido)-

Registry Numbers

CAS Registry Number

  • 22708-45-8

System Generated Number

  • 0022708458

Structure Descriptors

InChI

1S/C20H19I3N2O4/c1-3-25(11(2)26)19-15(22)10-14(21)17(18(19)23)20(29)24-13-7-4-12(5-8-13)6-9-16(27)28/h4-5,7-8,10H,3,6,9H2,1-2H3,(H,24,29)(H,27,28)

InChIKey

XWTKEJJYSRRQPC-UHFFFAOYSA-N

Smiles

c1(CCC(O)=O)ccc(cc1)NC(=O)c1c(cc(c(c1I)N(C(=O)C)CC)I)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 830mg/kg (830mg/kg)   Helvetica Chimica Acta. Vol. 52, Pg. 1339, 1969.
mouse LD50 oral 6gm/kg (6000mg/kg)   Helvetica Chimica Acta. Vol. 52, Pg. 1339, 1969.