Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 6,13-Dichloro-3,10-bis((2-((4-chloro-6-((2,4-disulphophenyl)amino)-1,3,5-triazin-2-yl)amino)ethyl)amino)triphenodioxazine-4,11-disulphonic acid
RN: 84455-40-3
InChIKey: KNSIUPJENVIPLE-UHFFFAOYSA-N

Molecular Formula

  • C40-H30-Cl4-N14-O20-S6

Molecular Weight

  • 1360.963
 
* 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 282-902-6

Systematic Name

  • 6,13-Dichloro-3,10-bis((2-((4-chloro-6-((2,4-disulphophenyl)amino)-1,3,5-triazin-2-yl)amino)ethyl)amino)triphenodioxazine-4,11-disulphonic acid

Registry Numbers

CAS Registry Number

  • 84455-40-3

System Generated Number

  • 0084455403

Structure Descriptors

InChI

1S/C40H30Cl4N14O20S6/c41-25-28-32(78-30-20(50-28)6-8-22(34(30)84(74,75)76)46-10-12-48-38-54-36(44)56-40(58-38)52-18-4-2-16(80(62,63)64)14-24(18)82(68,69)70)26(42)27-31(25)77-29-19(49-27)5-7-21(33(29)83(71,72)73)45-9-11-47-37-53-35(43)55-39(57-37)51-17-3-1-15(79(59,60)61)13-23(17)81(65,66)67/h1-8,13-14,45-46H,9-12H2,(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70)(H,71,72,73)(H,74,75,76)(H2,47,51,53,55,57)(H2,48,52,54,56,58)

InChIKey

KNSIUPJENVIPLE-UHFFFAOYSA-N

Smiles

OS(=O)(=O)c1ccc(Nc2nc(Cl)nc(NCCNc3ccc4N=C5C(=C6Oc7c(ccc(NCCNc8nc(Cl)nc(Nc9ccc(cc9S(=O)(=O)O)S(=O)(=O)O)n8)c7S(=O)(=O)O)N=C6C(=C5Oc4c3S(=O)(=O)O)Cl)Cl)n2)c(c1)S(=O)(=O)O