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Substance Name: Hydrocinnamamide, N-hexyl-4-(2-(1-pyrrolidinyl)ethoxy)-alpha-(p-toluoylamino)-, (+-)-
RN: 57227-90-4
InChIKey: CUSBWBKXZPGKAS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H41-N3-O3

Molecular Weight

  • 479.661
 
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Names and Synonyms

Synonyms

  • (+-)-N-Hexyl-4-(2-(1-pyrrolidinyl)ethoxy)-alpha-(p-toluoylamino)hydrocinnamamide
  • CR 826
  • O-(2-Pyrrolidyl-N'-ethyl)-N-toluoyl-DL-tyrosyl-n-hexylamide

Systematic Name

  • Hydrocinnamamide, N-hexyl-4-(2-(1-pyrrolidinyl)ethoxy)-alpha-(p-toluoylamino)-, (+-)-

Registry Numbers

CAS Registry Number

  • 57227-90-4

System Generated Number

  • 0057227904

Structure Descriptors

InChI

1S/C29H41N3O3/c1-3-4-5-6-17-30-29(34)27(31-28(33)25-13-9-23(2)10-14-25)22-24-11-15-26(16-12-24)35-21-20-32-18-7-8-19-32/h9-16,27H,3-8,17-22H2,1-2H3,(H,30,34)(H,31,33)

InChIKey

CUSBWBKXZPGKAS-UHFFFAOYSA-N

Smiles

C([C@@H](NC(c1ccc(C)cc1)=O)C(NCCCCCC)=O)c1ccc(OCCN2CCCC2)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 41mg/kg (41mg/kg)   United States Patent Document. Vol. #4004008,