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Substance Name: Acetic acid, (3-(N-methylbutyramido)-2,4,6-triiodophenyl)-
RN: 29193-37-1
InChIKey: QCDXRJMPYFIKEH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-I3-N-O3

Molecular Weight

  • 612.958
 
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Names and Synonyms

Synonyms

  • (3-(N-Methylbutyramido)-2,4,6-triiodophenyl)acetic acid
  • BRN 3003896

Systematic Name

  • Acetic acid, (3-(N-methylbutyramido)-2,4,6-triiodophenyl)-

Registry Numbers

CAS Registry Number

  • 29193-37-1

System Generated Number

  • 0029193371

Structure Descriptors

InChI

1S/C13H14I3NO3/c1-3-4-10(18)17(2)13-9(15)6-8(14)7(12(13)16)5-11(19)20/h6H,3-5H2,1-2H3,(H,19,20)

InChIKey

QCDXRJMPYFIKEH-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)cc1I)CC(O)=O)I)N(C(CCC)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 559, 1970.
mouse LD50 oral 880mg/kg (880mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 559, 1970.