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Substance Name: Tetrasodium 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3-sulfophenyl)amino)-4,11-triphenodioxazinedisulfonate
RN: 172776-95-3
UNII: 3A5G3JY2K4
InChIKey: GHUJUHMYIWLUFN-UHFFFAOYSA-J

Molecular Formula

  • C36-H14-Cl6-N12-O14-S4.4Na

Molecular Weight

  • 1271.5186
 
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Names and Synonyms

Name of Substance

  • Tetrasodium 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3-sulfophenyl)amino)-4,11-triphenodioxazinedisulfonate

Synonyms

  • 4,11-Triphenodioxazinedisulfonic acid, 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3-sulfophenyl)amino)-, sodium salt (1:4)
  • 4,11-Triphenodioxazinedisulfonic acid, 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3-sulfophenyl)amino)-, tetrasodium salt
  • Tetrasodium 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-3-sulfophenyl)amino)-4,11-triphenodioxazinedisulfonate
  • Tetrasodium 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)sulfophenyl)amino)triphenodioxazinedisulfonate
  • Triphenodioxazinedisulfonic acid, 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)sulfophenyl)amino)-, sodium salt (1:4)
  • Triphenodioxazinedisulfonic acid, 6,13-dichloro-3,10-bis((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)sulfophenyl)amino)-, tetrasodium salt
  • UNII-3A5G3JY2K4

Registry Numbers

CAS Registry Number

  • 172776-95-3

FDA UNII

  • 3A5G3JY2K4

System Generated Number

  • 0172776953

Structure Descriptors

InChI

1S/C36H18Cl6N12O14S4.4Na/c37-21-24-28(68-26-16(46-24)6-8-18(30(26)72(64,65)66)44-12-2-4-14(20(10-12)70(58,59)60)48-36-53-33(41)50-34(42)54-36)22(38)23-27(21)67-25-15(45-23)5-7-17(29(25)71(61,62)63)43-11-1-3-13(19(9-11)69(55,56)57)47-35-51-31(39)49-32(40)52-35;;;;/h1-10,43-44H,(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,47,49,51,52)(H,48,50,53,54);;;;/q;4*+1/p-4

InChIKey

GHUJUHMYIWLUFN-UHFFFAOYSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c1cc(Nc2ccc3N=C4C(=C5Oc6c(ccc(Nc7ccc(Nc8nc(Cl)nc(Cl)n8)c(c7)S(=O)(=O)[O-])c6S(=O)(=O)[O-])N=C5C(=C4Oc3c2S(=O)(=O)[O-])Cl)Cl)ccc1Nc9nc(Cl)nc(Cl)n9