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Substance Name: 1-Benzyl-4,5-dihydro-1-(2-((1-oxotetradecyl)amino)ethyl)-2-tridecyl-1H-imidazolium chloride
RN: 97337-77-4
InChIKey: CEWKGAJIXLTVBL-UHFFFAOYSA-N

Molecular Formula

  • C39-H70-N3-O.Cl

Molecular Weight

  • 632.455
 
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Names and Synonyms

Synonym

  • EINECS 306-571-5

Systematic Name

  • 1-Benzyl-4,5-dihydro-1-(2-((1-oxotetradecyl)amino)ethyl)-2-tridecyl-1H-imidazolium chloride

Registry Numbers

CAS Registry Number

  • 97337-77-4

System Generated Number

  • 0097337774

Molecular Formulas

Molecular Formula

  • C39-H70-N3-O.Cl

Molecular Formula Fragments

  • C39-H70-N3-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C39H69N3O.ClH/c1-3-5-7-9-11-13-15-17-19-21-26-30-38-40-32-34-42(38,36-37-28-24-23-25-29-37)35-33-41-39(43)31-27-22-20-18-16-14-12-10-8-6-4-2;/h23-25,28-29H,3-22,26-27,30-36H2,1-2H3;1H

InChIKey

CEWKGAJIXLTVBL-UHFFFAOYSA-N

Smiles

C1(=NCC[N@@+]1(CCNC(CCCCCCCCCCCCC)=O)Cc1ccccc1)CCCCCCCCCCCCC.[ClH-]