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Substance Name: 2,7-Naphthalenedisulfonic acid, 4-amino-6-(2-(2-chloro-4-nitrophenyl)diazenyl)-5-hydroxy-3-(2-(2-hydroxy-4-((3-hydroxy-4-(2-(4-((4-nitro-2-sulfophenyl)amino)phenyl)diazenyl)phenyl)amino)phenyl)diazenyl)-
RN: 68134-20-3
InChIKey: ZZHHEPKITYCYPQ-QSQIZDQASA-N

Molecular Formula

  • C40-H28-Cl-N11-O16-S3

Molecular Weight

  • 1050.37
 
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Names and Synonyms

Synonym

  • EINECS 268-733-0

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 4-amino-6-((2-chloro-4-nitrophenyl)azo)-5-hydroxy-3-((2-hydroxy-4-((3-hydroxy-4-((4-((4-nitro-2-sulfophenyl)amino)phenyl)azo)phenyl)amino)phenyl)azo)-
  • 2,7-Naphthalenedisulfonic acid, 4-amino-6-(2-(2-chloro-4-nitrophenyl)diazenyl)-5-hydroxy-3-(2-(2-hydroxy-4-((3-hydroxy-4-(2-(4-((4-nitro-2-sulfophenyl)amino)phenyl)diazenyl)phenyl)amino)phenyl)diazenyl)-
  • 4-Amino-6-((2-chloro-4-nitrophenyl)azo)-5-hydroxy-3-((2-hydroxy-4-((3-hydroxy-4-((4-((4-nitro-2-sulphophenyl)amino)phenyl)azo)phenyl)amino)phenyl)azo)naphthalene-2,7-disulphonic acid

Registry Numbers

CAS Registry Number

  • 68134-20-3

System Generated Number

  • 0068134203

Structure Descriptors

InChI

1S/C40H28ClN11O16S3/c41-26-17-24(51(56)57)7-11-27(26)46-50-39-35(71(66,67)68)14-19-13-34(70(63,64)65)38(37(42)36(19)40(39)55)49-48-29-10-6-23(16-32(29)54)43-22-5-9-28(31(53)15-22)47-45-21-3-1-20(2-4-21)44-30-12-8-25(52(58)59)18-33(30)69(60,61)62/h1-18,43-44,53-55H,42H2,(H,60,61,62)(H,63,64,65)(H,66,67,68)/b47-45+,49-48+,50-46+

InChIKey

ZZHHEPKITYCYPQ-QSQIZDQASA-N

Smiles

c1c(c(c(c2c(c(c(cc12)S(=O)(=O)O)\N=N\c1c(cc(cc1)[N+](=O)[O-])Cl)O)N)\N=N\c1c(cc(cc1)Nc1cc(c(cc1)\N=N\c1ccc(cc1)Nc1c(cc(cc1)[N+](=O)[O-])S(=O)(=O)O)O)O)S(=O)(=O)O