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Substance Name: 5-((4'-((8-((2,4-Dihydroxy-3-((2-methoxy-5-sulphophenyl)azo)phenyl)azo)-1-hydroxy-3,6-disulpho-2-naphthyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)salicylic acid
RN: 93964-59-1
InChIKey: RXUKCQTWXBGTEZ-KWVMDBLTSA-N

Molecular Formula

  • C44-H34-N8-O18-S3

Molecular Weight

  • 1058.9886
 
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Names and Synonyms

Synonym

  • EINECS 300-905-3

Systematic Name

  • 5-((4'-((8-((2,4-Dihydroxy-3-((2-methoxy-5-sulphophenyl)azo)phenyl)azo)-1-hydroxy-3,6-disulpho-2-naphthyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)salicylic acid

Registry Numbers

CAS Registry Number

  • 93964-59-1

System Generated Number

  • 0093964591

Structure Descriptors

InChI

1S/C44H34N8O18S3/c1-68-35-13-7-25(71(59,60)61)19-31(35)49-51-40-34(54)12-10-30(42(40)55)48-50-32-20-26(72(62,63)64)14-23-17-38(73(65,66)67)41(43(56)39(23)32)52-47-29-9-5-22(16-37(29)70-3)21-4-8-28(36(15-21)69-2)46-45-24-6-11-33(53)27(18-24)44(57)58/h4-20,53-56H,1-3H3,(H,57,58)(H,59,60,61)(H,62,63,64)(H,65,66,67)/b46-45+,50-48+,51-49+,52-47+

InChIKey

RXUKCQTWXBGTEZ-KWVMDBLTSA-N

Smiles

c1(c(c(c2c(/N=N/c3c(c(/N=N/c4cc(S(=O)(=O)O)ccc4OC)c(cc3)O)O)cc(S(=O)(=O)O)cc2c1)O)/N=N/c1c(cc(c2cc(c(/N=N/c3cc(C(=O)O)c(cc3)O)cc2)OC)cc1)OC)S(=O)(=O)O