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Substance Name: EINECS 267-227-7
RN: 67827-63-8
InChIKey: TYTTWEGYXSNOBA-QYGUTFKISA-N

Molecular Formula

  • C34-H29-N11-O6

Molecular Weight

  • 687.674
 
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Names and Synonyms

Results Name

  • EINECS 267-227-7

Synonym

  • EINECS 267-227-7

Systematic Names

  • 2-((1-(4-Aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-5-((3-((1-(4-aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-4-hydroxybenzoyl)amino)benzoic acid
  • Benzoic acid, 2-((1-(4-aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-5-((3-((1-(4-aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-4-hydroxybenzoyl)amino)-
  • Benzoic acid, 2-(2-(1-(4-aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)diazenyl)-5-((3-(2-(1-(4-aminophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)diazenyl)-4-hydroxybenzoyl)amino)-

Registry Numbers

CAS Registry Number

  • 67827-63-8

System Generated Number

  • 0067827638

Structure Descriptors

InChI

1S/C34H29N11O6/c1-17-29(32(48)44(42-17)23-9-4-20(35)5-10-23)40-38-26-13-8-22(16-25(26)34(50)51)37-31(47)19-3-14-28(46)27(15-19)39-41-30-18(2)43-45(33(30)49)24-11-6-21(36)7-12-24/h3-16,29-30,46H,35-36H2,1-2H3,(H,37,47)(H,50,51)/b40-38+,41-39+

InChIKey

TYTTWEGYXSNOBA-QYGUTFKISA-N

Smiles

C(c1c(ccc(c1)NC(c1cc(c(cc1)O)\N=N\[C@@H]1C(=NN(C1=O)c1ccc(cc1)N)C)=O)\N=N\[C@@H]1C(=NN(C1=O)c1ccc(cc1)N)C)(=O)O