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Substance Name: Carbanilic acid, p-pentyloxy-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (E)-
RN: 38198-49-1
InChIKey: WXVZVDUJBKGWPL-IYZPEQFLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H34-N2-O3.Cl-H

Molecular Weight

  • 410.983
 
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Names and Synonyms

Synonym

  • p-Pentyloxycarbanilic acid trans-2-(1-pyrrolidinyl)cyclohexyl ester hydrochloride

Systematic Name

  • Carbanilic acid, p-pentyloxy-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 38198-49-1

System Generated Number

  • 0038198491

Molecular Formulas

Molecular Formula

  • C22-H34-N2-O3.Cl-H

Molecular Formula Fragments

  • C22-H34-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H34N2O3.ClH/c1-2-3-8-17-26-19-13-11-18(12-14-19)23-22(25)27-21-10-5-4-9-20(21)24-15-6-7-16-24;/h11-14,20-21H,2-10,15-17H2,1H3,(H,23,25);1H/t20?,21-;/m1./s1

InChIKey

WXVZVDUJBKGWPL-IYZPEQFLSA-N

Smiles

[NH+]1([C@@H]2[C@H](OC(Nc3ccc(OCCCCC)cc3)=O)CCCC2)CCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 20mg/kg (20mg/kg)   Archiv der Pharmazie Vol. 305, Pg. 648, 1972.
mouse LD50 subcutaneous 300mg/kg (300mg/kg)   Archiv der Pharmazie Vol. 305, Pg. 648, 1972.