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Substance Name: 3-Pyrrolidinecarboxamide, N-(2-(2,6-dimethylphenoxy)-1-methylethyl)-2,2,5,5-tetramethyl-, monohydrochloride
RN: 93968-98-0
InChIKey: XNVDFJWXQPCVOE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H32-N2-O2.Cl-H

Molecular Weight

  • 368.9457
 
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Names and Synonyms

Synonym

  • N-(2-(2,6-Dimethylphenoxy)-1-methylethyl)-2,2,5,5-tetramethyl-3-pyrrolidinecarboxamide HCl

Systematic Name

  • 3-Pyrrolidinecarboxamide, N-(2-(2,6-dimethylphenoxy)-1-methylethyl)-2,2,5,5-tetramethyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 93968-98-0

System Generated Number

  • 0093968980

Molecular Formulas

Molecular Formula

  • C20-H32-N2-O2.Cl-H

Molecular Formula Fragments

  • C20-H32-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H32N2O2.ClH/c1-13-9-8-10-14(2)17(13)24-12-15(3)21-18(23)16-11-19(4,5)22-20(16,6)7;/h8-10,15-16,22H,11-12H2,1-7H3,(H,21,23);1H

InChIKey

XNVDFJWXQPCVOE-UHFFFAOYSA-N

Smiles

C1(C(=O)NC(COc2c(cccc2C)C)C)C(NC(C1)(C)C)(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2mg/kg (2mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.