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Substance Name: Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldiethyl-, dibromide, p-nitrophenyl ester
RN: 19143-09-0
InChIKey: IIBSXRUONXELFM-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H52-N5-O4-P.2Br

Molecular Weight

  • 785.598
 
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Names and Synonyms

Synonyms

  • (Phosphinicobis(iminotrimethylene))bis(benzyldiethylammonium bromide) p-nitrophenyl ester
  • H.C. 9013

Systematic Name

  • Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldiethyl-, dibromide, p-nitrophenyl ester

Registry Numbers

CAS Registry Number

  • 19143-09-0

System Generated Number

  • 0019143090

Molecular Formulas

Molecular Formula

  • C34-H52-N5-O4-P.2Br

Molecular Formula Fragments

  • Br
  • C34-H52-N5-O4-P
  • COMPONENT

Structure Descriptors

InChI

1S/C34H52N5O4P.2BrH/c1-5-38(6-2,29-31-17-11-9-12-18-31)27-15-25-35-44(42,43-34-23-21-33(22-24-34)37(40)41)36-26-16-28-39(7-3,8-4)30-32-19-13-10-14-20-32;;/h9-14,17-24H,5-8,15-16,25-30H2,1-4H3,(H2,35,36,42);2*1H/q+2;;/p-2

InChIKey

IIBSXRUONXELFM-UHFFFAOYSA-L

Smiles

[N+](Cc1ccccc1)(CCCNP(Oc1ccc([N+](=O)[O-])cc1)(NCCC[N+](Cc1ccccc1)(CC)CC)=O)(CC)CC.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4mg/kg (4mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 178, Pg. 269, 1969.