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Substance Name: EINECS 240-932-7
RN: 16893-48-4
InChIKey: SDNMRBNQFIJFSV-XAHDOWKMSA-N

Molecular Formula

  • C25-H18-Cl3-N9-O10-S3

Molecular Weight

  • 807.027
 
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Names and Synonyms

Results Name

  • EINECS 240-932-7

Synonym

  • EINECS 240-932-7

Systematic Names

  • 4-((4-Chloro-6-((4-sulphophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-((1-(2,5-dichloro-4-sulphophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonic acid
  • Benzenesulfonic acid, 4-((4-chloro-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-((1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-
  • Benzenesulfonic acid, 4-((4-chloro-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-(2-(1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)diazenyl)-

Registry Numbers

CAS Registry Number

  • 16893-48-4

Other Registry Numbers

  • 12238-03-8
  • 12239-46-2
  • 181188-60-3
  • 916419-73-3

System Generated Number

  • 0016893484

Structure Descriptors

InChI

1S/C25H18Cl3N9O10S3/c1-11-21(22(38)37(36-11)18-9-16(27)20(10-15(18)26)50(45,46)47)35-34-17-8-13(4-7-19(17)49(42,43)44)30-25-32-23(28)31-24(33-25)29-12-2-5-14(6-3-12)48(39,40)41/h2-10,21H,1H3,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H2,29,30,31,32,33)/b35-34+

InChIKey

SDNMRBNQFIJFSV-XAHDOWKMSA-N

Smiles

O=C1N(N=C(C)[C@@H]1\N=N\c1c(S(=O)(=O)O)ccc(Nc2nc(nc(Nc3ccc(S(=O)(=O)O)cc3)n2)Cl)c1)c1c(cc(S(=O)(=O)O)c(Cl)c1)Cl