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Substance Name: 3,12-Diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane, 3,12-bis(1-(hydroxyimino)-2-oxopropyl)-, dichloride
RN: 149986-18-5
InChIKey: PYLZSQPDTAADNG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H32-N6-O4.2Cl

Molecular Weight

  • 467.3948
 
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Names and Synonyms

Synonym

  • N,N'''-Bis(1-hydroxyimino-2-oxopropyl)-N',N''-dispirotripiperazinium dichloride

Systematic Name

  • 3,12-Diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane, 3,12-bis(1-(hydroxyimino)-2-oxopropyl)-, dichloride

Registry Numbers

CAS Registry Number

  • 149986-18-5

System Generated Number

  • 0149986185

Molecular Formulas

Molecular Formula

  • C18-H32-N6-O4.2Cl

Molecular Formula Fragments

  • C18-H32-N6-O4
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C18H30N6O4.2ClH/c1-15(25)17(19-27)21-3-7-23(8-4-21)11-13-24(14-12-23)9-5-22(6-10-24)18(20-28)16(2)26;;/h3-14H2,1-2H3;2*1H

InChIKey

PYLZSQPDTAADNG-UHFFFAOYSA-N

Smiles

CC(=O)/C(=N/O)/N1CC[N+]2(CC[N+]3(CC2)CCN(CC3)/C(=N\O)/C(=O)C)CC1.[Cl-].[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD unreported > 2500mg/kg (2500mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 730, 1993.