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Substance Name: 4,5-Dihydro-1-methyl-1-(3-((1-oxododecyl)amino)propyl)-2-undecyl-1H-imidazolium methyl sulphate
RN: 94022-81-8
InChIKey: NGLQSUGHNOMQAH-UHFFFAOYSA-N

Molecular Formula

  • C30-H60-N3-O.C-H3-O4-S

Molecular Weight

  • 589.9207
 
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Names and Synonyms

Synonym

  • EINECS 301-576-9

Systematic Name

  • 4,5-Dihydro-1-methyl-1-(3-((1-oxododecyl)amino)propyl)-2-undecyl-1H-imidazolium methyl sulphate

Registry Numbers

CAS Registry Number

  • 94022-81-8

System Generated Number

  • 0094022818

Molecular Formulas

Molecular Formula

  • C30-H60-N3-O.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C30-H60-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C30H59N3O.CH4O4S/c1-4-6-8-10-12-14-16-18-20-23-29-31-26-28-33(29,3)27-22-25-32-30(34)24-21-19-17-15-13-11-9-7-5-2;1-5-6(2,3)4/h4-28H2,1-3H3;1H3,(H,2,3,4)

InChIKey

NGLQSUGHNOMQAH-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCC1=NCC[N+]1(C)CCCNC(=O)CCCCCCCCCCC.COS(=O)(=O)[O-]