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Substance Name: Benzamide, 5-((p-((2-chloroethyl)ethylamino)benzyl)amino)-2,4-dinitro-
RN: 32868-94-3
InChIKey: BOGCVTRLRZILNV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Cl-N5-O5

Molecular Weight

  • 421.839
 
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Names and Synonyms

Synonym

  • 5-((p-((2-Chloroethyl)ethylamino)benzyl)amino)-2,4-dinitrobenzamide

Systematic Name

  • Benzamide, 5-((p-((2-chloroethyl)ethylamino)benzyl)amino)-2,4-dinitro-

Registry Numbers

CAS Registry Number

  • 32868-94-3

System Generated Number

  • 0032868943

Structure Descriptors

InChI

1S/C18H20ClN5O5/c1-2-22(8-7-19)13-5-3-12(4-6-13)11-21-15-9-14(18(20)25)16(23(26)27)10-17(15)24(28)29/h3-6,9-10,21H,2,7-8,11H2,1H3,(H2,20,25)

InChIKey

BOGCVTRLRZILNV-UHFFFAOYSA-N

Smiles

c1(c(cc([N+](=O)[O-])c(c1)C(N)=O)[N+](=O)[O-])NCc1ccc(N(CCCl)CC)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 158mg/kg (158mg/kg)   Chemico-Biological Interactions. Vol. 3, Pg. 95, 1971.