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Substance Name: Carbanilic acid, o-(butoxymethyl)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride
RN: 80171-83-1
InChIKey: CIGRHTIBLDYHCH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H32-N2-O3.Cl-H

Molecular Weight

  • 384.945
 
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Names and Synonyms

Synonyms

  • 2-(Hexahydro-1H-azepin-1-yl)ethyl o-(butoxymethyl)carbanilate hydrochloride
  • AMK 245
  • o-(Butoxymethyl)carbanilic acid 2-(hexahydro-1H-azepin-1-yl)ethyl ester hydrochloride

Systematic Name

  • Carbanilic acid, o-(butoxymethyl)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 80171-83-1

System Generated Number

  • 0080171831

Molecular Formulas

Molecular Formula

  • C20-H32-N2-O3.Cl-H

Molecular Formula Fragments

  • C20-H32-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H32N2O3.ClH/c1-2-3-15-24-17-18-10-6-7-11-19(18)21-20(23)25-16-14-22-12-8-4-5-9-13-22;/h6-7,10-11H,2-5,8-9,12-17H2,1H3,(H,21,23);1H

InChIKey

CIGRHTIBLDYHCH-UHFFFAOYSA-N

Smiles

c1(c(NC(OCC[NH+]2CCCCCC2)=O)cccc1)COCCCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 50mg/kg (50mg/kg)   Cesko-Slovenska Farmacie. Vol. 30, Pg. 184, 1981.