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Substance Name: 9-Anthroic acid, 9,10-dihydro-9-methyl-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 66827-82-5
InChIKey: GROUTKAJQGPOOC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O2.Cl-H

Molecular Weight

  • 373.921
 
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Names and Synonyms

Synonym

  • 9,10-Dihydro-9-methyl-9-anthroic acid -2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • 9-Anthroic acid, 9,10-dihydro-9-methyl-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66827-82-5

System Generated Number

  • 0066827825

Molecular Formulas

Molecular Formula

  • C22-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO2.ClH/c1-4-23(5-2)14-15-25-21(24)22(3)19-12-8-6-10-17(19)16-18-11-7-9-13-20(18)22;/h6-13H,4-5,14-16H2,1-3H3;1H

InChIKey

GROUTKAJQGPOOC-UHFFFAOYSA-N

Smiles

C1(c2c(Cc3c1cccc3)cccc2)(C(OCC[NH+](CC)CC)=O)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of the American Chemical Society. Vol. 65, Pg. 1582, 1943.