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Substance Name: 5-Chloro-2-(2-(4-((2-cyanoethyl)ethylamino)-o-tolyl)vinyl)-1,3,3-trimethyl-3H-indolium chloride
RN: 32783-03-2
InChIKey: WVCKTHFKVZTZHI-UHFFFAOYSA-M

Molecular Formula

  • C25-H29-Cl-N3.Cl

Molecular Weight

  • 442.4311
 
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Names and Synonyms

Synonym

  • EINECS 251-213-2

Systematic Name

  • 5-Chloro-2-(2-(4-((2-cyanoethyl)ethylamino)-o-tolyl)vinyl)-1,3,3-trimethyl-3H-indolium chloride

Registry Numbers

CAS Registry Number

  • 32783-03-2

System Generated Number

  • 0032783032

Molecular Formulas

Molecular Formula

  • C25-H29-Cl-N3.Cl

Molecular Formula Fragments

  • C25-H29-Cl-N3
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C25H29ClN3.ClH/c1-6-29(15-7-14-27)21-11-8-19(18(2)16-21)9-13-24-25(3,4)22-17-20(26)10-12-23(22)28(24)5;/h8-13,16-17H,6-7,15H2,1-5H3;1H/q+1;/p-1

InChIKey

WVCKTHFKVZTZHI-UHFFFAOYSA-M

Smiles

CCN(CCC#N)c1ccc(c(c1)C)/C=C/C2=[N+](c3ccc(cc3C2(C)C)Cl)C.[Cl-]