3,8-Diazabicyclo(3.2.1)octane, 3-(3-(p-nitrophenyl)allyl)-8-propionyl-, hydrochloride

CAS 448-35-1 MFCD N/A

化学结构图

448-35-1
SMILES: CCC(=O)N1CC2CC1CN(C/C=C/c1ccc([N+](=O)[O-])cc1)C2.Cl

化学属性

Mol. Weight365.90
Mol. FormulaC18H23N3O3.ClH

别名和识别编码

Wiswesser Line NotationT56 A AN GNTJ AV2 G2U1R DNW &GH
Chemical Name3,8-Diazabicyclo(3.2.1)octane, 3-(3-(p-nitrophenyl)allyl)-8-propionyl-, hydrochloride
Synonym 3-(3-(p-Nitrophenyl)allyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane
CAS Number448-35-1
InChIKeyQYTWNLVAHAWOCD-BJILWQEISA-N
PubChem Substance ID6433186
InChIInChI=1S/C18H23N3O3.ClH/c1-2-18(22)20-12-15-10-17(20)13-19(11-15)9-3-4-14-5-7-16(8-6-14)21(23)24;/h3-8,15,17H,2,9-13H2,1H3;1H/b4-3+;
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安全信息

RTECSHM0511700 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 25 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 8,326,1965

系列性分类

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