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Substance Name: 4-Amino-6-((4-((4-((4-(diethylamino)-2-hydroxyphenyl)azo)phenyl)amino)-3-sulphophenyl)azo)-5-hydroxy-3-((4-nitrophenyl)azo)naphthalene-2,7-disulphonic acid, sodium salt
RN: 94200-89-2
InChIKey: YLIDMVVIVUYIDJ-OJEQMUCHSA-K

Molecular Formula

  • C38-H34-N10-O13-S3.x-Na

Molecular Weight

  • 1000.8879
 
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Names and Synonyms

Synonym

  • EINECS 303-569-6

Systematic Name

  • 4-Amino-6-((4-((4-((4-(diethylamino)-2-hydroxyphenyl)azo)phenyl)amino)-3-sulphophenyl)azo)-5-hydroxy-3-((4-nitrophenyl)azo)naphthalene-2,7-disulphonic acid, sodium salt

Registry Numbers

CAS Registry Number

  • 94200-89-2

System Generated Number

  • 0094200892

Molecular Formulas

Molecular Formula

  • C38-H34-N10-O13-S3.x-Na

Molecular Formula Fragments

  • C38-H34-N10-O13-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H34N10O13S3.3Na/c1-3-47(4-2)27-14-16-28(30(49)20-27)44-41-23-7-5-22(6-8-23)40-29-15-11-25(19-31(29)62(53,54)55)43-46-37-33(64(59,60)61)18-21-17-32(63(56,57)58)36(35(39)34(21)38(37)50)45-42-24-9-12-26(13-10-24)48(51)52;;;/h5-20,40,49-50H,3-4,39H2,1-2H3,(H,53,54,55)(H,56,57,58)(H,59,60,61);;;/q;3*+1/p-3/b44-41+,45-42+,46-43+;;;

InChIKey

YLIDMVVIVUYIDJ-OJEQMUCHSA-K

Smiles

c1(S(=O)(=O)[O-])c(c(c2c(c(c(S(=O)(=O)[O-])cc2c1)/N=N/c1cc(S(=O)(=O)[O-])c(Nc2ccc(/N=N/c3c(cc(N(CC)CC)cc3)O)cc2)cc1)O)N)/N=N/c1ccc([N+](=O)[O-])cc1.[Na+].[Na+].[Na+]