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Substance Name: Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-butyl-N-methylamino)ethyl) ester, hydrochloride
RN: 2912-80-3
InChIKey: CBBBHOILUGRKBJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N-O3.Cl-H

Molecular Weight

  • 405.963
 
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Names and Synonyms

Synonym

  • 2,2-Diphenyl-2-ethoxyacetic acid (2-(N-butyl-N-methylamino)ethyl) ester hydrochloride

Systematic Name

  • Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-butyl-N-methylamino)ethyl) ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 2912-80-3

System Generated Number

  • 0002912803

Molecular Formulas

Molecular Formula

  • C23-H31-N-O3.Cl-H

Molecular Formula Fragments

  • C23-H31-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H31NO3.ClH/c1-4-6-17-24(3)18-19-26-22(25)23(27-5-2,20-13-9-7-10-14-20)21-15-11-8-12-16-21;/h7-16H,4-6,17-19H2,1-3H3;1H

InChIKey

CBBBHOILUGRKBJ-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(c1ccccc1)(C(OCC[N@@H+](CCCC)C)=O)OCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 23mg/kg (23mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 571, 1965.