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Substance Name: Benzoic acid, o-bromo-, 5-(2-(dimethylamino)ethoxy)carvacryl ester, hydrochloride
RN: 16809-75-9
InChIKey: FJVLMDVFLAWLCX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-Br-N-O3.Cl-H

Molecular Weight

  • 456.805
 
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Names and Synonyms

Synonyms

  • 5-(2-(Dimethylamino)ethoxy)carvacryl o-bromobenzoate hydrochloride
  • WV 848

Systematic Name

  • Benzoic acid, o-bromo-, 5-(2-(dimethylamino)ethoxy)carvacryl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 16809-75-9

System Generated Number

  • 0016809759

Molecular Formulas

Molecular Formula

  • C21-H26-Br-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H26-Br-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26BrNO3.ClH/c1-14(2)17-13-19(15(3)12-20(17)25-11-10-23(4)5)26-21(24)16-8-6-7-9-18(16)22;/h6-9,12-14H,10-11H2,1-5H3;1H

InChIKey

FJVLMDVFLAWLCX-UHFFFAOYSA-N

Smiles

C(c1c(cccc1)Br)(=O)Oc1cc(C(C)C)c(cc1C)OCCN(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 450mg/kg (450mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 305, 1967.