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Substance Name: 3,8-Diazabicyclo(3.2.1)octane, 8-((alpha-carboxy)-p-toluoyl)-3-methyl-
RN: 57269-43-9
InChIKey: LVDCIFZWIXIYMZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-N2-O3

Molecular Weight

  • 288.345
 
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Names and Synonyms

Synonyms

  • 5-23-03-00462 (Beilstein Handbook Reference)
  • 8-((alpha-Carboxy)-p-toluoyl)-3-methyl-3,8-diazabicyclo(3.2.1)octane
  • BRN 0556336

Systematic Name

  • 3,8-Diazabicyclo(3.2.1)octane, 8-((alpha-carboxy)-p-toluoyl)-3-methyl-

Registry Numbers

CAS Registry Number

  • 57269-43-9

System Generated Number

  • 0057269439

Structure Descriptors

InChI

1S/C16H20N2O3/c1-17-7-6-12-8-14(17)18(10-12)16(21)13-4-2-11(3-5-13)9-15(19)20/h2-5,12,14H,6-10H2,1H3,(H,19,20)

InChIKey

LVDCIFZWIXIYMZ-UHFFFAOYSA-N

Smiles

c1(CC(=O)O)ccc(C(=O)N2[C@@H]3[N@@](CC[C@@H](C3)C2)C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Research Progress in Organic-Biological and Medicinal Chemistry. Vol. 2, Pg. 205, 1970.