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Substance Name: 1-Pyrrolidinepropanol, 3-(o-methoxyphenoxy)-, benzoate (ester), oxalate (1:1)
RN: 23026-52-0
InChIKey: RWXUAXZBVQALCH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N-O4.C2-H2-O4

Molecular Weight

  • 445.465
 
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Names and Synonyms

Synonym

  • 3-(o-Methoxyphenoxy)-1-pyrrolidinepropanol benzoate (ester) oxalate (1:1)

Systematic Name

  • 1-Pyrrolidinepropanol, 3-(o-methoxyphenoxy)-, benzoate (ester), oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 23026-52-0

System Generated Number

  • 0023026520

Molecular Formulas

Molecular Formula

  • C21-H25-N-O4.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H25-N-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25NO4.C2H2O4/c1-24-19-10-5-6-11-20(19)26-18-12-14-22(16-18)13-7-15-25-21(23)17-8-3-2-4-9-17;3-1(4)2(5)6/h2-6,8-11,18H,7,12-16H2,1H3;(H,3,4)(H,5,6)

InChIKey

RWXUAXZBVQALCH-UHFFFAOYSA-N

Smiles

C(=O)(O)C(=O)O.C(c1ccccc1)(=O)OCCC[N@@]1C[C@@H](CC1)Oc1c(cccc1)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Journal of Medicinal Chemistry. Vol. 12, Pg. 442, 1969.