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Substance Name: 2,7-Naphthalenedisulfonic acid, 4-amino-3-((4-((4-((4-amino-2-hydroxyphenyl)azo)benzoyl)amino)phenyl)azo)-5-hydroxy-6-(phenylazo)-
RN: 116897-98-4
InChIKey: SIJMTVRUZVXCQD-AUVAVNHBSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C35-H27-N9-O9-S2

Molecular Weight

  • 781.784
 
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Names and Synonyms

Synonym

  • Direct Black GB NB

Systematic Name

  • 2,7-Naphthalenedisulfonic acid, 4-amino-3-((4-((4-((4-amino-2-hydroxyphenyl)azo)benzoyl)amino)phenyl)azo)-5-hydroxy-6-(phenylazo)-

Registry Numbers

CAS Registry Number

  • 116897-98-4

System Generated Number

  • 0116897984

Structure Descriptors

InChI

1S/C35H27N9O9S2/c36-21-8-15-26(27(45)18-21)42-39-24-9-6-19(7-10-24)35(47)38-22-11-13-25(14-12-22)41-43-32-28(54(48,49)50)16-20-17-29(55(51,52)53)33(34(46)30(20)31(32)37)44-40-23-4-2-1-3-5-23/h1-18,45-46H,36-37H2,(H,38,47)(H,48,49,50)(H,51,52,53)/b42-39+,43-41+,44-40+

InChIKey

SIJMTVRUZVXCQD-AUVAVNHBSA-N

Smiles

c1c(c(c(c2c(c(c(cc12)S(=O)(=O)O)\N=N\c1ccccc1)O)N)\N=N\c1ccc(cc1)NC(c1ccc(cc1)\N=N\c1c(cc(cc1)N)O)=O)S(=O)(=O)O