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Substance Name: Phenethylamine, N-benzyl-N,alpha-dimethyl-m-(trifluoromethyl)-, cyclohexanesulfamate, (+-)-
RN: 5918-33-2
InChIKey: CWGHGWCBGWQJLF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-F3-N.C6-H13-O3-S

Molecular Weight

  • 486.596
 
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Names and Synonyms

Synonym

  • N-Benzyl-N,alpha-dimethyl-m-(trifluoromethyl)phenethylamine cyclohexanesulfamate

Systematic Name

  • Phenethylamine, N-benzyl-N,alpha-dimethyl-m-(trifluoromethyl)-, cyclohexanesulfamate, (+-)-

Registry Numbers

CAS Registry Number

  • 5918-33-2

System Generated Number

  • 0005918332

Molecular Formulas

Molecular Formula

  • C18-H20-F3-N.C6-H13-O3-S

Molecular Formula Fragments

  • C18-H20-F3-N
  • C6-H13-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C18H20F3N.C6H13NO3S/c1-14(22(2)13-15-7-4-3-5-8-15)11-16-9-6-10-17(12-16)18(19,20)21;8-11(9,10)7-6-4-2-1-3-5-6/h3-10,12,14H,11,13H2,1-2H3;6-7H,1-5H2,(H,8,9,10)

InChIKey

CWGHGWCBGWQJLF-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)C(F)(F)F)C[C@@H](C)[N@@](Cc1ccccc1)C.S(=O)(=O)(O)NC1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Annales Pharmaceutiques Francaises. Vol. 24, Pg. 57, 1966.