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Substance Name: Propiophenone, 2-phenyl-3-(1-pyrrolidinyl)-3',4',5'-trimethoxy-, hydrochloride
RN: 40281-32-1
InChIKey: GVEHAHIPWCDIMQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Weight

  • 405.9192
 
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Names and Synonyms

Synonym

  • 2-Phenyl-3-(1-pyrrolidinyl)-3',4',5'-trimethoxypropiophenone hydrochloride

Systematic Name

  • Propiophenone, 2-phenyl-3-(1-pyrrolidinyl)-3',4',5'-trimethoxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 40281-32-1

System Generated Number

  • 0040281321

Molecular Formulas

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO4.ClH/c1-25-19-13-17(14-20(26-2)22(19)27-3)21(24)18(15-23-11-7-8-12-23)16-9-5-4-6-10-16;/h4-6,9-10,13-14,18H,7-8,11-12,15H2,1-3H3;1H

InChIKey

GVEHAHIPWCDIMQ-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)C(=O)C(CN2CCCC2)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 142mg/kg (142mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 1243, 1972.