Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzenemethanaminium, N-butyl-N-(4-((4-(butyl((3-sulfophenyl)methyl)amino)-2-methylphenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)-3-methyl-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, sodium salt (1:1)
RN: 182212-42-6
InChIKey: RXGULWIEFXJVSY-UHFFFAOYSA-M

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C51-H57-N3-O7-S2.Na

Molecular Weight

  • 910.1394
 
* 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

  • Benzenemethanaminium, N-butyl-N-(4-((4-(butyl((3-sulfophenyl)methyl)amino)-2-methylphenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)-3-methyl-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, monosodium salt
  • Benzenemethanaminium, N-butyl-N-(4-((4-(butyl((3-sulfophenyl)methyl)amino)-2-methylphenyl)(4-((4-ethoxyphenyl)amino)phenyl)methylene)-3-methyl-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, sodium salt (1:1)

Registry Numbers

CAS Registry Number

  • 182212-42-6

System Generated Number

  • 0182212426

Molecular Formulas

Molecular Formula

  • C51-H57-N3-O7-S2.Na

Molecular Formula Fragments

  • C51-H57-N3-O7-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C51H57N3O7S2.Na/c1-6-9-29-53(35-39-13-11-15-47(33-39)62(55,56)57)44-23-27-49(37(4)31-44)51(41-17-19-42(20-18-41)52-43-21-25-46(26-22-43)61-8-3)50-28-24-45(32-38(50)5)54(30-10-7-2)36-40-14-12-16-48(34-40)63(58,59)60;/h11-28,31-34H,6-10,29-30,35-36H2,1-5H3,(H2,55,56,57,58,59,60);/q;+1/p-1

InChIKey

RXGULWIEFXJVSY-UHFFFAOYSA-M