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Substance Name: Ammonium, (4-((4,6-diamino-m-tolyl)imino)-2,5-cyclohexadien-1-ylidene)dimethyl-, chloride, monohydrate
RN: 6424-34-6
InChIKey: SBHAXIXLNVUZCC-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C15-H19-N4.Cl.H2-O

Molecular Weight

  • 308.811
 
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Names and Synonyms

Synonyms

  • (4-((4,6-Diamino-m-tolyl)imino)-2,5-cyclohexadien-1-ylidene)dimethylammonium chloride H2O
  • Toluylene Blue monohydrate

Systematic Name

  • Ammonium, (4-((4,6-diamino-m-tolyl)imino)-2,5-cyclohexadien-1-ylidene)dimethyl-, chloride, monohydrate

Registry Numbers

CAS Registry Number

  • 6424-34-6

System Generated Number

  • 0006424346

Molecular Formulas

Molecular Formula

  • C15-H19-N4.Cl.H2-O

Molecular Formula Fragments

  • C15-H19-N4
  • Cl
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C15H18N4.ClH.H2O/c1-10-8-15(14(17)9-13(10)16)18-11-4-6-12(7-5-11)19(2)3;;/h4-9H,1-3H3,(H3,16,17);1H;1H2

InChIKey

SBHAXIXLNVUZCC-UHFFFAOYSA-N

Smiles

[N+](=C1\C=C\C(C=C1)=N/c1c(cc(c(c1)C)N)N)(\C)C.[ClH-].O