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Substance Name: Coumarin, 3-((2-(dibutylamino)ethyl)carbamoyl)-4-hydroxy-, monohydrochloride
RN: 1922-70-9
InChIKey: MYTVFTKZBZMRQQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H28-N2-O4.Cl-H

Molecular Weight

  • 396.912
 
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Names and Synonyms

Synonym

  • 3-((2-(Dibutylamino)ethyl)carbamoyl)-4-hydroxycoumarin hydrochloride

Systematic Name

  • Coumarin, 3-((2-(dibutylamino)ethyl)carbamoyl)-4-hydroxy-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 1922-70-9

System Generated Number

  • 0001922709

Molecular Formulas

Molecular Formula

  • C20-H28-N2-O4.Cl-H

Molecular Formula Fragments

  • C20-H28-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H28N2O4.ClH/c1-3-5-12-22(13-6-4-2)14-11-21-19(24)17-18(23)15-9-7-8-10-16(15)26-20(17)25;/h7-10,23H,3-6,11-14H2,1-2H3,(H,21,24);1H

InChIKey

MYTVFTKZBZMRQQ-UHFFFAOYSA-N

Smiles

c12c(oc(=O)c(c1O)C(NCC[NH+](CCCC)CCCC)=O)cccc2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1200mg/kg (1200mg/kg)   Medicina et Pharmacologia Experimentalis. Vol. 17, Pg. 497, 1967.