Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-(2-(4-((2-Chloroethyl)methylamino)phenyl)vinyl)-1,3,3-trimethyl-3H-indolium methyl sulphate
RN: 85204-55-3
InChIKey: BRCNZYZVEHXRLP-UHFFFAOYSA-M

Molecular Formula

  • C22-H26-Cl-N2.C-H3-O4-S

Molecular Weight

  • 465.0111
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 286-342-3

Systematic Name

  • 2-(2-(4-((2-Chloroethyl)methylamino)phenyl)vinyl)-1,3,3-trimethyl-3H-indolium methyl sulphate

Registry Numbers

CAS Registry Number

  • 85204-55-3

System Generated Number

  • 0085204553

Molecular Formulas

Molecular Formula

  • C22-H26-Cl-N2.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C22-H26-Cl-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H26ClN2.CH4O4S/c1-22(2)19-7-5-6-8-20(19)25(4)21(22)14-11-17-9-12-18(13-10-17)24(3)16-15-23;1-5-6(2,3)4/h5-14H,15-16H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

BRCNZYZVEHXRLP-UHFFFAOYSA-M

Smiles

CC1(c2ccccc2[N+](=C1/C=C/c3ccc(cc3)N(C)CCCl)C)C.COS(=O)(=O)[O-]