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Substance Name: Isoeicosenoic acid, 2-(2-((4-chloro-3-((4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)amino)phenyl)amino)-2-oxoethyl)-
RN: 68758-77-0
InChIKey: YATOPWSWDHHXFS-ONEGZZNKSA-N

Molecular Formula

  • C37-H48-Cl4-N4-O4

Molecular Weight

  • 754.622
 
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Names and Synonyms

Synonym

  • EINECS 272-153-3

Systematic Names

  • 2-(2-((4-Chloro-3-((4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)amino)phenyl)amino)-2-oxoethyl)isoicosenoic acid
  • Isoeicosenoic acid, 2-(2-((4-chloro-3-((4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)amino)phenyl)amino)-2-oxoethyl)-

Registry Numbers

CAS Registry Number

  • 68758-77-0

System Generated Number

  • 0068758770

Structure Descriptors

InChI

1S/C37H48Cl4N4O4/c1-25(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-26(37(48)49)20-34(46)42-28-18-19-29(39)32(23-28)43-33-24-35(47)45(44-33)36-30(40)21-27(38)22-31(36)41/h3-4,18-19,21-23,25-26H,5-17,20,24H2,1-2H3,(H,42,46)(H,43,44)(H,48,49)/b4-3+

InChIKey

YATOPWSWDHHXFS-ONEGZZNKSA-N

Smiles

C(C(Nc1cc(c(cc1)Cl)NC1=NN(c2c(cc(cc2Cl)Cl)Cl)C(=O)C1)=O)[C@@H](C(O)=O)CCCCCCC\C=C\CCCCCCC(C)C