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Substance Name: Ammonium, (terephthaloylbis(iminoethylene))bis(diethyl(p-nitrobenzyl)-, dibromide
ID: BS53360000
InChIKey: QBDQKXDYPOVYGU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H46-N6-O6.2Br

Molecular Weight

  • 794.5814
 
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Names and Synonyms

Synonyms

  • (Terephthaloylbis(iminoethylene))bis(diethyl(p-nitrobenzyl)ammonium bromide)
  • Ro 2-4489

Systematic Name

  • Ammonium, (terephthaloylbis(iminoethylene))bis(diethyl(p-nitrobenzyl)-, dibromide

Registry Numbers

ID Number

  • NIOSH/BS5336000

System Generated Number

  • BS53360000

Molecular Formulas

Molecular Formula

  • C34-H46-N6-O6.2Br

Molecular Formula Fragments

  • Br
  • C34-H46-N6-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C34H44N6O6.2BrH/c1-5-39(6-2,25-27-9-17-31(18-10-27)37(43)44)23-21-35-33(41)29-13-15-30(16-14-29)34(42)36-22-24-40(7-3,8-4)26-28-11-19-32(20-12-28)38(45)46;;/h9-20H,5-8,21-26H2,1-4H3;2*1H

InChIKey

QBDQKXDYPOVYGU-UHFFFAOYSA-N

Smiles

[Br-].[Br-].CC[N+](CC)(CCNC(=O)c1ccc(cc1)C(=O)NCC[N+](CC)(CC)Cc2ccc(cc2)[N+](=O)[O-])Cc3ccc(cc3)[N+](=O)[O-]