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Substance Name: 4-((4-Ammonio-3-methylphenyl)(4-iminio-3-methylcyclohexa-2,5-dien-1-ylidene)methyl)-2-methylanilinium phosphate
RN: 85188-04-1
InChIKey: BKEYGGUAIMXXOE-UHFFFAOYSA-K

Molecular Formula

  • C22-H23-N3.H3-O4-P

Molecular Weight

  • 427.4384
 
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Names and Synonyms

Synonym

  • EINECS 286-195-5

Systematic Name

  • 4-((4-Ammonio-3-methylphenyl)(4-iminio-3-methylcyclohexa-2,5-dien-1-ylidene)methyl)-2-methylanilinium phosphate

Registry Numbers

CAS Registry Number

  • 85188-04-1

System Generated Number

  • 0085188041

Molecular Formulas

Molecular Formula

  • C22-H23-N3.H3-O4-P

Molecular Formula Fragments

  • C22-H23-N3
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C22H26N3.H3O4P/c1-16-7-12-25(15-17(16)2)22(20-8-10-23(5)18(3)13-20)21-9-11-24(6)19(4)14-21;1-5(2,3)4/h7-15H,1H2,2-6H3;(H3,1,2,3,4)/q+3;/p-3

InChIKey

BKEYGGUAIMXXOE-UHFFFAOYSA-K

Smiles

Cc1cc(cc[n+]1C)C(=[n+]2ccc(=C)c(c2)C)c3cc[n+](c(c3)C)C.[O-]P(=O)([O-])[O-]