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Substance Name: Ethanone, 2-((1-methylethyl)(phenylmethyl)amino)-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, hydrochloride
RN: 42882-45-1
InChIKey: YTUGXIODVKTIHS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N-O.Cl-H

Molecular Weight

  • 371.949
 
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Names and Synonyms

  • Ethanone, 2-((1-methylethyl)(phenylmethyl)amino)-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 42882-45-1

System Generated Number

  • 0042882451

Molecular Formulas

Molecular Formula

  • C23-H29-N-O.Cl-H

Molecular Formula Fragments

  • C23-H29-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H29NO.ClH/c1-18(2)24(16-19-9-5-3-6-10-19)17-23(25)22-14-13-20-11-7-4-8-12-21(20)15-22;/h3,5-6,9-10,13-15,18H,4,7-8,11-12,16-17H2,1-2H3;1H

InChIKey

YTUGXIODVKTIHS-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)C(C[N@@H+](Cc1ccccc1)C(C)C)=O)CCCCC2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 37, Pg. 3501, 1972.