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Substance Name: Carbanilic acid, m-butoxy-, 2-(diethylamino)cyclohexyl ester, hydrochloride, (E)-
RN: 38198-30-0
InChIKey: HFXQIEBZYKZYFV-YFUYRHFLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H34-N2-O3.Cl-H

Molecular Weight

  • 398.971
 
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Names and Synonyms

Synonyms

  • (E)-2-(Diethylamino)cyclohexyl m-butoxycarbanilate hydrochloride
  • m-Butoxycarbanilic acid trans-2-(diethylamino)cyclohexyl ester hydrochloride

Systematic Name

  • Carbanilic acid, m-butoxy-, 2-(diethylamino)cyclohexyl ester, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 38198-30-0

System Generated Number

  • 0038198300

Molecular Formulas

Molecular Formula

  • C21-H34-N2-O3.Cl-H

Molecular Formula Fragments

  • C21-H34-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H34N2O3.ClH/c1-4-5-14-25-19-11-8-10-18(16-19)22-21(24)26-15-13-17-9-6-7-12-20(17)23(2)3;/h8,10-11,16-17,20H,4-7,9,12-15H2,1-3H3,(H,22,24);1H/t17-,20+;/m0./s1

InChIKey

HFXQIEBZYKZYFV-YFUYRHFLSA-N

Smiles

C([C@H]1[C@@H](CCCC1)[NH+](C)C)COC(Nc1cc(ccc1)OCCCC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15mg/kg (15mg/kg)   Archiv der Pharmazie Vol. 305, Pg. 648, 1972.
mouse LD50 subcutaneous 150mg/kg (150mg/kg)   Archiv der Pharmazie Vol. 305, Pg. 648, 1972.