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Substance Name: 2H-1-Benzopyran-2-one, 8-((cyclohexyl(1-methylethyl)amino)methyl)-7-hydroxy-4-methyl-, hydrochloride
RN: 57028-64-5
InChIKey: KYNXWIOSBZHSFW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O3.Cl-H

Molecular Weight

  • 365.8982
 
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Names and Synonyms

Synonym

  • 8-((Cyclohexyl(1-methylethyl)amino)methyl)-7-hydroxy-4-methyl-2H-1-benzopyran-2-one HCl

Systematic Name

  • 2H-1-Benzopyran-2-one, 8-((cyclohexyl(1-methylethyl)amino)methyl)-7-hydroxy-4-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 57028-64-5

System Generated Number

  • 0057028645

Molecular Formulas

Molecular Formula

  • C20-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27NO3.ClH/c1-13(2)21(15-7-5-4-6-8-15)12-17-18(22)10-9-16-14(3)11-19(23)24-20(16)17;/h9-11,13,15,22H,4-8,12H2,1-3H3;1H

InChIKey

KYNXWIOSBZHSFW-UHFFFAOYSA-N

Smiles

Cc1cc(=O)oc2c1ccc(c2CN(C3CCCCC3)C(C)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 700mg/kg (700mg/kg)   Research Communications in Chemical Pathology and Pharmacology. Vol. 11, Pg. 651, 1975.