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Substance Name: Pyrrolidinium, 1,1'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(1,2-dimethyl-, dibromide
RN: 123489-62-3
InChIKey: GAEDBMWCVYSYET-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H38-N2-O2.2Br

Molecular Weight

  • 594.4282
 
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Names and Synonyms

Synonym

  • 4,4'-Bis((2-methylpyrrolidino)acetyl)biphenyl dimethiobromide

Systematic Name

  • Pyrrolidinium, 1,1'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(1,2-dimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 123489-62-3

System Generated Number

  • 0123489623

Molecular Formulas

Molecular Formula

  • C28-H38-N2-O2.2Br

Molecular Formula Fragments

  • Br
  • C28-H38-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C28H38N2O2.2BrH/c1-21-7-5-17-29(21,3)19-27(31)25-13-9-23(10-14-25)24-11-15-26(16-12-24)28(32)20-30(4)18-6-8-22(30)2;;/h9-16,21-22H,5-8,17-20H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

GAEDBMWCVYSYET-UHFFFAOYSA-L

Smiles

CC1CCC[N+]1(C)CC(=O)c2ccc(cc2)c3ccc(cc3)C(=O)C[N+]4(CCCC4C)C.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 398ug/kg (0.398mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 577, 1990.