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Substance Name: 2,5-Dichloro-4-(4,5-dihydro-3-methyl-5-oxo-4-((4-sulphophenyl)azo)-1H-pyrazol-1-yl)benzenesulphonic acid, compound with N,N'-di-o-tolylguanidine (1:2)
RN: 84753-00-4
InChIKey: QILDUVCJEUKTRT-LLIZZRELSA-N

Molecular Formula

  • C16-H12-Cl2-N4-O7-S2.2C15-H17-N3

Molecular Weight

  • 985.9704
 
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Names and Synonyms

Synonym

  • EINECS 283-846-5

Systematic Name

  • 2,5-Dichloro-4-(4,5-dihydro-3-methyl-5-oxo-4-((4-sulphophenyl)azo)-1H-pyrazol-1-yl)benzenesulphonic acid, compound with N,N'-di-o-tolylguanidine (1:2)

Registry Numbers

CAS Registry Number

  • 84753-00-4

System Generated Number

  • 0084753004

Molecular Formulas

Molecular Formula

  • C16-H12-Cl2-N4-O7-S2.2C15-H17-N3

Molecular Formula Fragments

  • C15-H17-N3
  • C16-H12-Cl2-N4-O7-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C16H12Cl2N4O7S2.2C15H17N3/c1-8-15(20-19-9-2-4-10(5-3-9)30(24,25)26)16(23)22(21-8)13-6-12(18)14(7-11(13)17)31(27,28)29;2*1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h2-7,15H,1H3,(H,24,25,26)(H,27,28,29);2*3-10H,1-2H3,(H3,16,17,18)/b20-19+;;

InChIKey

QILDUVCJEUKTRT-LLIZZRELSA-N

Smiles

Cc1ccccc1NC(=N)Nc2ccccc2C.Cc1ccccc1NC(=N)Nc2ccccc2C.CC1=NN(C(=O)C1/N=N/c2ccc(cc2)S(=O)(=O)O)c3cc(c(cc3Cl)S(=O)(=O)O)Cl