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Substance Name: 4-Amino-6-((4'-((2,4-diamino-5-sulphophenyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-5-hydroxy-3-((4-nitrophenyl)azo)naphthalene-2,7-disulphonic acid, sodium salt
RN: 83763-77-3
InChIKey: NEJBFWSWGKXQHX-PHDDRHBNSA-K

Molecular Formula

  • C36-H30-N10-O14-S3.x-Na

Molecular Weight

  • 988.8333
 
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Names and Synonyms

Synonym

  • EINECS 280-765-7

Systematic Name

  • 4-Amino-6-((4'-((2,4-diamino-5-sulphophenyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-5-hydroxy-3-((4-nitrophenyl)azo)naphthalene-2,7-disulphonic acid, sodium salt

Registry Numbers

CAS Registry Number

  • 83763-77-3

System Generated Number

  • 0083763773

Molecular Formulas

Molecular Formula

  • C36-H30-N10-O14-S3.x-Na

Molecular Formula Fragments

  • C36-H30-N10-O14-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C36H30N10O14S3.3Na/c1-59-27-11-17(3-9-24(27)41-43-26-16-29(61(50,51)52)23(38)15-22(26)37)18-4-10-25(28(12-18)60-2)42-45-35-31(63(56,57)58)14-19-13-30(62(53,54)55)34(33(39)32(19)36(35)47)44-40-20-5-7-21(8-6-20)46(48)49;;;/h3-16,47H,37-39H2,1-2H3,(H,50,51,52)(H,53,54,55)(H,56,57,58);;;/q;3*+1/p-3/b43-41+,44-40+,45-42+;;;

InChIKey

NEJBFWSWGKXQHX-PHDDRHBNSA-K

Smiles

COc1cc(ccc1/N=N/c2cc(c(cc2N)N)S(=O)(=O)[O-])c3ccc(c(c3)OC)/N=N/c4c(cc5cc(c(c(c5c4O)N)/N=N/c6ccc(cc6)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]