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Substance Name: 9H-Xanthen-9-one, 2-(((1-(hydroxymethyl)-1-methylethyl)amino)methyl)-, hydrochloride
RN: 126929-79-1
InChIKey: QODYKCRQOYPRNH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-N-O3.Cl-H

Molecular Weight

  • 333.813
 
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Names and Synonyms

Synonym

  • 2-(((1-(Hydroxymethyl)-1-methylethyl)amino)methyl)-9H-xanthen-9-one hydrochloride

Systematic Name

  • 9H-Xanthen-9-one, 2-(((1-(hydroxymethyl)-1-methylethyl)amino)methyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 126929-79-1

System Generated Number

  • 0126929791

Molecular Formulas

Molecular Formula

  • C18-H19-N-O3.Cl-H

Molecular Formula Fragments

  • C18-H19-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H19NO3.ClH/c1-18(2,11-20)19-10-12-7-8-16-14(9-12)17(21)13-5-3-4-6-15(13)22-16;/h3-9,19-20H,10-11H2,1-2H3;1H

InChIKey

QODYKCRQOYPRNH-UHFFFAOYSA-N

Smiles

CC(C)(CO)NCc1ccc2c(c1)c(=O)c3ccccc3o2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 420mg/kg (420mg/kg)   Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 46, Pg. 227, 1989.