Chem
J-GLOBAL ID：200907009757616324   Nikkaji number：J22.969E

QX-314

QX-314
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H27N[N+]O
Molecular formula furigana： C16-H27-N2-O
Molecular weight： 263.404
InChI： InChI=1S/C16H26N2O/c1-6-18(7-2,8-3)12-15(19)17-16-13(4)10-9-11-14(16)5/h9-11H,6-8,12H2,1-5H3/p+1
InChI key： PYEBKOFMWAMBFV-UHFFFAOYSA-O
SMILES： CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C
Systematic name  (3)：
  • 2-[(2,6-ジメチルフェニル)アミノ]-N,N,N-トリエチル-2-オキソエタンアミニウム
  • {[(2,6-ジメチルフェニル)カルバモイル]メチル}トリエチルアザニウム
  • {[(2,6-dimethylphenyl)carbamoyl]methyl}triethylazanium
Other name (2)：
  • QX-314
  • 2-[(2,6-Dimethylphenyl)amino]-N,N,N-triethyl-2-oxoethanaminium
CAS registry number： 21306-56-9
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