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Substance Name: Pyrrolidinium, 1-benzyl-3-hydroxy-1-methyl-, bromide, alpha-phenylcyclohexaneacetate
RN: 102584-61-2
InChIKey: JICIXIVHIBWVKF-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H34-N-O2.Br

Molecular Weight

  • 472.4636
 
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Names and Synonyms

Synonyms

  • 1-Benzyl-3-hydroxy-1-methylpyrrolidinium bromide alpha-phenylcyclohexaneacetate
  • AHR 282

Systematic Name

  • Pyrrolidinium, 1-benzyl-3-hydroxy-1-methyl-, bromide, alpha-phenylcyclohexaneacetate

Registry Numbers

CAS Registry Number

  • 102584-61-2

System Generated Number

  • 0102584612

Molecular Formulas

Molecular Formula

  • C26-H34-N-O2.Br

Molecular Formula Fragments

  • Br
  • C26-H34-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C26H34NO2.BrH/c1-27(19-21-11-5-2-6-12-21)18-17-24(20-27)29-26(28)25(22-13-7-3-8-14-22)23-15-9-4-10-16-23;/h2-3,5-8,11-14,23-25H,4,9-10,15-20H2,1H3;1H/q+1;/p-1

InChIKey

JICIXIVHIBWVKF-UHFFFAOYSA-M

Smiles

C[N+]1(CCC(C1)OC(=O)C(c2ccccc2)C3CCCCC3)Cc4ccccc4.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 40mg/kg (40mg/kg) SENSE ORGANS AND SPECIAL SENSES: MYDRIASIS (PUPILLARY DILATION): EYE

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 523, 1960.