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Substance Name: Carbanilic acid, m-bromo-, N-ethyl-3-piperidinyl ester
RN: 33531-53-2
InChIKey: DMBFFBKRQNVNGD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-Br-N2-O2

Molecular Weight

  • 327.22
 
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Names and Synonyms

Synonyms

  • 5-21-01-00041 (Beilstein Handbook Reference)
  • BRN 1475225
  • m-Bromocarbanilic acid, N-ethyl-3-piperidinyl ester
  • N-Ethyl-3-piperidinyl m-bromocarbanilate

Systematic Name

  • Carbanilic acid, m-bromo-, N-ethyl-3-piperidinyl ester

Registry Numbers

CAS Registry Number

  • 33531-53-2

System Generated Number

  • 0033531532

Structure Descriptors

InChI

1S/C14H19BrN2O2/c1-2-17-8-4-7-13(10-17)19-14(18)16-12-6-3-5-11(15)9-12/h3,5-6,9,13H,2,4,7-8,10H2,1H3,(H,16,18)

InChIKey

DMBFFBKRQNVNGD-UHFFFAOYSA-N

Smiles

C1[C@@H](OC(Nc2cc(ccc2)Br)=O)CCC[N@@]1CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 48mg/kg (48mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 710, 1971.