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Substance Name: Ethanone, 2-((1,1-dimethylethyl)(phenymethyl)amino)-1-(4-hydroxy-3-(hydroxymethyl)phenyl)-, hydrochloride
RN: 24085-08-3
InChIKey: QXNITHCPVLQQEN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H25-N-O3.Cl-H

Molecular Weight

  • 363.882
 
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Names and Synonyms

Synonyms

  • 1-(4'-Hydroxy-3'-hydroxy-methylphenyl)-2-(benzyl-t-butylamino)ethanone hydrochloride
  • 2-((1,1-Dimethylethyl)(phenylmethyl)amino)-1-(4-hydroxy-3-(hydroxymethyl)phenyl)ethanone HCl
  • CCRIS 3459
  • EC 246-014-2
  • EINECS 246-014-2

Systematic Names

  • 1-(4'-Hydroxy-3'-hydroxymethyl)-2-(benzyl-tert-butylamino)ethanone hydrochloride
  • 2-(tert-Butyl(phenylmethyl)amino)-1-(4-hydroxy-3-(hydroxymethyl)phenyl) hydrochloride
  • Ethanone, 2-((1,1-dimethylethyl)(phenymethyl)amino)-1-(4-hydroxy-3-(hydroxymethyl)phenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 24085-08-3

System Generated Number

  • 0024085083

Molecular Formulas

Molecular Formula

  • C20-H25-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H25-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25NO3.ClH/c1-20(2,3)21(12-15-7-5-4-6-8-15)13-19(24)16-9-10-18(23)17(11-16)14-22;/h4-11,22-23H,12-14H2,1-3H3;1H

InChIKey

QXNITHCPVLQQEN-UHFFFAOYSA-N

Smiles

C(C[N@@](Cc1ccccc1)C(C)(C)C)(c1cc(c(cc1)O)CO)=O.Cl