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Substance Name: Benzyl(2-hydroxyethyl)methyl(3-((1-oxooctadec-9-enyl)amino)propyl)ammonium chloride
RN: 94108-21-1
InChIKey: RUKUQFXEZUPOEE-ASTDGNLGSA-N

Molecular Formula

  • C31-H55-N2-O2.Cl

Molecular Weight

  • 523.2405
 
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Names and Synonyms

Synonym

  • EINECS 302-360-7

Systematic Name

  • Benzyl(2-hydroxyethyl)methyl(3-((1-oxooctadec-9-enyl)amino)propyl)ammonium chloride

Registry Numbers

CAS Registry Number

  • 94108-21-1

System Generated Number

  • 0094108211

Molecular Formulas

Molecular Formula

  • C31-H55-N2-O2.Cl

Molecular Formula Fragments

  • C31-H55-N2-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C31H54N2O2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-31(35)32-25-21-26-33(2,27-28-34)29-30-22-18-17-19-23-30;/h10-11,17-19,22-23,34H,3-9,12-16,20-21,24-29H2,1-2H3;1H/b11-10+;

InChIKey

RUKUQFXEZUPOEE-ASTDGNLGSA-N

Smiles

C(CCNC(CCCCCCC\C=C\CCCCCCCC)=O)[N@@+](C)(CCO)Cc1ccccc1.[ClH-]