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Substance Name: Carbanilic acid, m-butoxy-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (E)-
RN: 38198-34-4
InChIKey: UAJABKFTASSJCB-FKLPMGAJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H32-N2-O3.Cl-H

Molecular Weight

  • 396.956
 
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Names and Synonyms

Synonyms

  • (E)-2-(1-Pyrrolidinyl)cyclohexyl m-butoxycarbanilate hydrochloride
  • m-Butoxycarbanilic acid trans-2-(1-pyrrolidinyl)cyclohexyl ester hydrochloride

Systematic Name

  • Carbanilic acid, m-butoxy-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 38198-34-4

System Generated Number

  • 0038198344

Molecular Formulas

Molecular Formula

  • C21-H32-N2-O3.Cl-H

Molecular Formula Fragments

  • C21-H32-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H32N2O3.ClH/c1-2-3-15-25-18-10-8-9-17(16-18)22-21(24)26-20-12-5-4-11-19(20)23-13-6-7-14-23;/h8-10,16,19-20H,2-7,11-15H2,1H3,(H,22,24);1H/t19-,20-;/m0./s1

InChIKey

UAJABKFTASSJCB-FKLPMGAJSA-N

Smiles

[NH+]1([C@@H]2[C@@H](OC(Nc3cc(ccc3)OCCCC)=O)CCCC2)CCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 100mg/kg (100mg/kg)   Archiv der Pharmazie Vol. 305, Pg. 648, 1972.