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Substance Name: Benzoic acid, 5-bromo-2-(2-((2-(diethylamino)ethyl)amino)-2-oxoethoxy)-
RN: 42973-09-1
InChIKey: LBGJJXPYDLOAFP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-Br-N2-O4

Molecular Weight

  • 373.245
 
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Names and Synonyms

Synonyms

  • BRN 3000661
  • N-(Diethylaminoethyl)-2-(4-bromo-2-carboxyphenoxy)acetamide

Systematic Name

  • Benzoic acid, 5-bromo-2-(2-((2-(diethylamino)ethyl)amino)-2-oxoethoxy)-

Registry Numbers

CAS Registry Number

  • 42973-09-1

System Generated Number

  • 0042973091

Structure Descriptors

InChI

1S/C15H21BrN2O4/c1-3-18(4-2)8-7-17-14(19)10-22-13-6-5-11(16)9-12(13)15(20)21/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,17,19)(H,20,21)

InChIKey

LBGJJXPYDLOAFP-UHFFFAOYSA-N

Smiles

C(c1c(ccc(c1)Br)OCC(=O)NCCN(CC)CC)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 511, 1973.
mouse LD50 oral > 300mg/kg (300mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 511, 1973.