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Substance Name: Benzoic acid, 3,3'-methylenebis(6-(2-(2,4-dihydroxy-5-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-
RN: 73507-51-4
InChIKey: BPOZSYOQHCIZJJ-SSBBCRENSA-N

Molecular Formula

  • C39-H28-N8-O14-S2

Molecular Weight

  • 896.8242
 
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Names and Synonyms

  • Benzoic acid, 3,3'-methylenebis(6-((2,4-dihydroxy-5-((4-sulfophenyl)azo)phenyl)azo)-
  • Benzoic acid, 3,3'-methylenebis(6-(2-(2,4-dihydroxy-5-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-

Registry Numbers

CAS Registry Number

  • 73507-51-4

System Generated Number

  • 0073507514

Structure Descriptors

InChI

1S/C39H28N8O14S2/c48-34-18-36(50)32(16-30(34)44-40-22-3-7-24(8-4-22)62(56,57)58)46-42-28-11-1-20(14-26(28)38(52)53)13-21-2-12-29(27(15-21)39(54)55)43-47-33-17-31(35(49)19-37(33)51)45-41-23-5-9-25(10-6-23)63(59,60)61/h1-12,14-19,48-51H,13H2,(H,52,53)(H,54,55)(H,56,57,58)(H,59,60,61)/b44-40+,45-41+,46-42+,47-43+

InChIKey

BPOZSYOQHCIZJJ-SSBBCRENSA-N

Smiles

c1c(ccc(c1)S(=O)(=O)O)/N=N/c2c(cc(c(c2)/N=N/c3c(cc(cc3)Cc4cc(c(cc4)/N=N/c5c(cc(c(c5)/N=N/c6ccc(cc6)S(=O)(=O)O)O)O)C(=O)O)C(=O)O)O)O