Chem
J-GLOBAL ID：200907000183053876   Nikkaji number：J204.187A

N,N-Dimethyl-N-benzyl-N-[1-[[(4-nonylphenyloxy)methyl]oxycarbonyl]butyl]aminium

ベンジルジメチル{1-[(4-ノニルフェノキシ)メトキシ]-1-オキソペンタン-2-イル}アザニウム
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： C30H46[N+]O3
Molecular formula furigana： C30-H46-N-O3
Molecular weight： 468.701
InChI： InChI=1S/C30H46NO3/c1-5-7-8-9-10-11-13-17-26-20-22-28(23-21-26)33-25-34-30(32)29(16-6-2)31(3,4)24-27-18-14-12-15-19-27/h12,14-15,18-23,29H,5-11,13,16-17,24-25H2,1-4H3/q+1
InChI key： DFELKBFHKOHFPW-UHFFFAOYSA-N
SMILES： CCCCCCCCCc1ccc(OCOC(=O)C(CCC)[N+](C)(C)Cc2ccccc2)cc1
Systematic name  (3)：
  • N,N-ジメチル-N-ベンジル-N-[1-[[(4-ノニルフェニルオキシ)メチル]オキシカルボニル]ブチル]アミニウム
  • ベンジルジメチル{1-[(4-ノニルフェノキシ)メトキシ]-1-オキソペンタン-2-イル}アザニウム
  • benzyldimethyl{1-[(4-nonylphenoxy)methoxy]-1-oxopentan-2-yl}azanium
Other name (1)：
  • N,N-Dimethyl-N-benzyl-N-[1-[[(4-nonylphenyloxy)methyl]oxycarbonyl]butyl]aminium
Regulation number (1)：
  • (3)-2721
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