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Substance Name: Benzoic acid, 2,6-dimethyl-4-propoxy-, 2-methyl-2-(1-pyrrolidinyl)propyl ester, hydrochloride
RN: 95619-40-2
InChIKey: CVLJQEVYYPWOOA-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C20-H31-N-O3.Cl-H

Molecular Weight

  • 369.93
 
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Names and Synonyms

Synonyms

  • 2,6-Dimethyl-4-propoxy-benzoic acid 2-methyl-2-(1-pyrrolidinyl)propyl ester
  • U-2363

Systematic Name

  • Benzoic acid, 2,6-dimethyl-4-propoxy-, 2-methyl-2-(1-pyrrolidinyl)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 95619-40-2

System Generated Number

  • 0095619402

Molecular Formulas

Molecular Formula

  • C20-H31-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H31-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H31NO3.ClH/c1-6-11-23-17-12-15(2)18(16(3)13-17)19(22)24-14-20(4,5)21-9-7-8-10-21;/h12-13H,6-11,14H2,1-5H3;1H

InChIKey

CVLJQEVYYPWOOA-UHFFFAOYSA-N

Smiles

c1(c(cc(OCCC)cc1C)C)C(OCC([NH+]1CCCC1)(C)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 55700mg/kg (55700mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 137, Pg. 410, 1962.