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Substance Name: Pyrrolidinium, 1-((bromophenyl)methyl)-2-(1-hydroxy-2-phenyl-1-(phenylmethyl)ethyl)-1-methyl-,iodide
RN: 79808-80-3
InChIKey: IHECJHZCXGZHIM-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H31-Br-N-O.I

Molecular Weight

  • 592.3519
 
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Names and Synonyms

Synonym

  • 1-(Bromobenzyl)-2-(1-hydroxy-2-phenyl-1-benzylethyl)-1-methylpyrrolidinium iodide

Systematic Name

  • Pyrrolidinium, 1-((bromophenyl)methyl)-2-(1-hydroxy-2-phenyl-1-(phenylmethyl)ethyl)-1-methyl-,iodide

Registry Numbers

CAS Registry Number

  • 79808-80-3

System Generated Number

  • 0079808803

Molecular Formulas

Molecular Formula

  • C27-H31-Br-N-O.I

Molecular Formula Fragments

  • C27-H31-Br-N-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C27H31BrNO.HI/c1-29(21-24-15-8-9-16-25(24)28)18-10-17-26(29)27(30,19-22-11-4-2-5-12-22)20-23-13-6-3-7-14-23;/h2-9,11-16,26,30H,10,17-21H2,1H3;1H/q+1;/p-1

InChIKey

IHECJHZCXGZHIM-UHFFFAOYSA-M

Smiles

C[N+]1(CCCC1C(Cc2ccccc2)(Cc3ccccc3)O)Cc4ccccc4Br.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral > 5gm/kg (5000mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Annales Pharmaceutiques Francaises. Vol. 39, Pg. 201, 1981.