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Substance Name: 3-Pyridinecarbonitrile, 2-amino-5-(2-(2-chloro-6-cyano-4-nitrophenyl)diazenyl)-6-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-
RN: 68877-62-3
InChIKey: XESUQLJISQTRDH-ZQHSETAFSA-N

Molecular Formula

  • C21-H23-Cl-N8-O4

Molecular Weight

  • 486.918
 
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Names and Synonyms

Synonym

  • EINECS 272-567-4

Systematic Names

  • 2-Amino-5-((2-chloro-6-cyano-4-nitrophenyl)azo)-6-((3-(4-hydroxybutoxy)propyl)amino)-4-methylnicotinonitrile
  • 3-Pyridinecarbonitrile, 2-amino-5-((2-chloro-6-cyano-4-nitrophenyl)azo)-6-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-
  • 3-Pyridinecarbonitrile, 2-amino-5-(2-(2-chloro-6-cyano-4-nitrophenyl)diazenyl)-6-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-

Registry Numbers

CAS Registry Number

  • 68877-62-3

System Generated Number

  • 0068877623

Structure Descriptors

InChI

1S/C21H23ClN8O4/c1-13-16(12-24)20(25)27-21(26-5-4-8-34-7-3-2-6-31)18(13)28-29-19-14(11-23)9-15(30(32)33)10-17(19)22/h9-10,31H,2-8H2,1H3,(H3,25,26,27)/b29-28+

InChIKey

XESUQLJISQTRDH-ZQHSETAFSA-N

Smiles

N#Cc1c(c(\N=N\c2c(C#N)cc([N+]([O-])=O)cc2Cl)c(nc1N)NCCCOCCCCO)C