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Substance Name: Pyrrolidine, 1-(1-oxo-4-(2-(2-phenylethyl)phenoxy)butyl)-2-(1-pyrrolidinylcarbonyl)-, (S)-
RN: 112604-01-0
InChIKey: MDCLEYBSFJDUNR-DEOSSOPVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H34-N2-O3

Molecular Weight

  • 434.5766
 
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Names and Synonyms

Synonyms

  • (S)-1-(1-Oxo-4-(2-(2-phenylethyl)phenoxy)butyl)-2-(1-pyrrolidinylcarbonyl)pyrrolidine
  • RTECS VK5103000
  • SUAM 1293

Systematic Name

  • Pyrrolidine, 1-(1-oxo-4-(2-(2-phenylethyl)phenoxy)butyl)-2-(1-pyrrolidinylcarbonyl)-, (S)-

Registry Numbers

CAS Registry Number

  • 112604-01-0

System Generated Number

  • 0112604010

Structure Descriptors

InChI

1S/C27H34N2O3/c30-26(29-20-8-13-24(29)27(31)28-18-6-7-19-28)15-9-21-32-25-14-5-4-12-23(25)17-16-22-10-2-1-3-11-22/h1-5,10-12,14,24H,6-9,13,15-21H2/t24-/m0/s1

InChIKey

MDCLEYBSFJDUNR-DEOSSOPVSA-N

Smiles

c1ccc(cc1)CCc2ccccc2OCCCC(=O)N3CCC[C@H]3C(=O)N4CCCC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg)   United States Patent Document. Vol. #4826870,