Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4-Amino-3,6-bis((5-((4-chloro-6-((3-sulphophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-5-hydroxynaphthalene-2,7-disulphonic acid
RN: 81417-94-9
InChIKey: KIZSBUXZSFRTCV-UHFFFAOYSA-N

Molecular Formula

  • C40-H29-Cl2-N15-O19-S6

Molecular Weight

  • 1287.0571
 
* 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 279-756-0

Systematic Name

  • 4-Amino-3,6-bis((5-((4-chloro-6-((3-sulphophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-5-hydroxynaphthalene-2,7-disulphonic acid

Registry Numbers

CAS Registry Number

  • 81417-94-9

System Generated Number

  • 0081417949

Structure Descriptors

InChI

1S/C40H29Cl2N15O19S6/c41-35-48-37(44-18-3-1-5-22(13-18)77(59,60)61)52-39(50-35)46-20-7-9-26(79(65,66)67)24(15-20)54-56-32-28(81(71,72)73)11-17-12-29(82(74,75)76)33(34(58)30(17)31(32)43)57-55-25-16-21(8-10-27(25)80(68,69)70)47-40-51-36(42)49-38(53-40)45-19-4-2-6-23(14-19)78(62,63)64/h1-16,58H,43H2,(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70)(H,71,72,73)(H,74,75,76)(H2,44,46,48,50,52)(H2,45,47,49,51,53)

InChIKey

KIZSBUXZSFRTCV-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)S(=O)(=O)O)Nc2nc(nc(n2)Cl)Nc3ccc(c(c3)N=Nc4c(cc5cc(c(c(c5c4N)O)N=Nc6cc(ccc6S(=O)(=O)O)Nc7nc(nc(n7)Cl)Nc8cccc(c8)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O