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Substance Name: Carbanilic acid, 1,1-bis(dimethylaminomethyl)-3-phenylpropyl ester, hydrochloride
RN: 69782-44-1
InChIKey: GJGJFSCFCXOKAL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-N3-O2.Cl-H

Molecular Weight

  • 405.967
 
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Names and Synonyms

Synonym

  • alpha,alpha-Di(dimethylaminomethyl)-gamma-phenylpropyl carbanilate hydrochloride

Systematic Name

  • Carbanilic acid, 1,1-bis(dimethylaminomethyl)-3-phenylpropyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69782-44-1

System Generated Number

  • 0069782441

Molecular Formulas

Molecular Formula

  • C22-H31-N3-O2.Cl-H

Molecular Formula Fragments

  • C22-H31-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H31N3O2.ClH/c1-24(2)17-22(18-25(3)4,16-15-19-11-7-5-8-12-19)27-21(26)23-20-13-9-6-10-14-20;/h5-14H,15-18H2,1-4H3,(H,23,26);1H

InChIKey

GJGJFSCFCXOKAL-UHFFFAOYSA-N

Smiles

C([C@@](OC(Nc1ccccc1)=O)(CN(C)C)C[NH+](C)C)Cc1ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 300mg/kg (300mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 61, Pg. 107, 1937.