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Substance Name: 2,5-Dichloro-4-(4,5-dihydro-3-methyl-5-oxo-4-((3-((phenylamino)sulphonyl)phenyl)azo)-1H-pyrazol-1-yl)benzenesulphonic acid
RN: 91101-21-2
InChIKey: NJOYTYKWRUYHOV-OCEACIFDSA-N

Molecular Formula

  • C22-H17-Cl2-N5-O6-S2

Molecular Weight

  • 582.4433
 
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Names and Synonyms

Synonym

  • EINECS 293-813-7

Systematic Name

  • 2,5-Dichloro-4-(4,5-dihydro-3-methyl-5-oxo-4-((3-((phenylamino)sulphonyl)phenyl)azo)-1H-pyrazol-1-yl)benzenesulphonic acid

Registry Numbers

CAS Registry Number

  • 91101-21-2

System Generated Number

  • 0091101212

Structure Descriptors

InChI

1S/C22H17Cl2N5O6S2/c1-13-21(22(30)29(27-13)19-11-18(24)20(12-17(19)23)37(33,34)35)26-25-15-8-5-9-16(10-15)36(31,32)28-14-6-3-2-4-7-14/h2-12,21,28H,1H3,(H,33,34,35)/b26-25+

InChIKey

NJOYTYKWRUYHOV-OCEACIFDSA-N

Smiles

CC1=NN(C(=O)C1/N=N/c2cccc(c2)S(=O)(=O)Nc3ccccc3)c4cc(c(cc4Cl)S(=O)(=O)O)Cl