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Substance Name: 4,5-Dihydro-2-isoheptadecyl-1-methyl-1-(2-((1-oxoisooctadecyl)amino)ethyl)-1H-imidazolium methyl sulphate
RN: 94022-92-1
InChIKey: DYHWEPOMUOYZEG-UHFFFAOYSA-N

Molecular Formula

  • C41-H82-N3-O.C-H3-O4-S

Molecular Weight

  • 744.2155
 
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Names and Synonyms

Synonym

  • EINECS 301-586-3

Systematic Name

  • 4,5-Dihydro-2-isoheptadecyl-1-methyl-1-(2-((1-oxoisooctadecyl)amino)ethyl)-1H-imidazolium methyl sulphate

Registry Numbers

CAS Registry Number

  • 94022-92-1

System Generated Number

  • 0094022921

Molecular Formulas

Molecular Formula

  • C41-H82-N3-O.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C41-H82-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C41H81N3O.CH4O4S/c1-38(2)30-26-22-18-14-10-6-8-12-16-20-24-28-32-40-42-34-36-44(40,5)37-35-43-41(45)33-29-25-21-17-13-9-7-11-15-19-23-27-31-39(3)4;1-5-6(2,3)4/h38-39H,6-37H2,1-5H3;1H3,(H,2,3,4)

InChIKey

DYHWEPOMUOYZEG-UHFFFAOYSA-N

Smiles

S(=O)(=O)([O-])OC.[N+]1(C(=NCC1)CCCCCCCCCCCCCCC(C)C)(CCNC(=O)CCCCCCCCCCCCCCC(C)C)C