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Substance Name: Methanone, 2-benzofuranyl(4-((dimethylamino)methyl)-5-hydroxy-2-methyl-3-benzofuranyl)-, hydrochloride, hydrate
RN: 132993-98-7
InChIKey: LFFIXALQWNVAHQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-N-O4.Cl-H.H2-O

Molecular Weight

  • 385.845
 
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Names and Synonyms

Synonym

  • 2-Methyl-3-(benzofuroyl-2')-4-dimethylaminomethyl-5-hydroxybenzofuran hydrochloride hydrate

Systematic Name

  • Methanone, 2-benzofuranyl(4-((dimethylamino)methyl)-5-hydroxy-2-methyl-3-benzofuranyl)-, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 132993-98-7

System Generated Number

  • 0132993987

Molecular Formulas

Molecular Formula

  • C21-H19-N-O4.Cl-H.H2-O

Molecular Formula Fragments

  • C21-H19-N-O4
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C21H19NO4.ClH/c1-12-19(21(24)18-10-13-6-4-5-7-16(13)26-18)20-14(11-22(2)3)15(23)8-9-17(20)25-12;/h4-10,23H,11H2,1-3H3;1H

InChIKey

LFFIXALQWNVAHQ-UHFFFAOYSA-N

Smiles

Cc1c(c2c(o1)ccc(c2CN(C)C)O)C(=O)c3cc4ccccc4o3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 24, Pg. 896, 1990.