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Substance Name: 1,3-Naphthalenedisulfonic acid, 7-(2-(4-((((4-(2-(6,8-disulfo-2-naphthalenyl)diazenyl)-2-methoxy-5-methylphenyl)amino)carbonyl)amino)-2-methoxy-5-methylphenyl)diazenyl)-, sodium salt (1:4)
RN: 96446-42-3
InChIKey: SMHWQKMWYMTYSD-INRNMLHDSA-J

Molecular Formula

  • C37-H32-N6-O15-S4.4Na

Molecular Weight

  • 1016.8792
 
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Names and Synonyms

  • 1,3-Naphthalenedisulfonic acid, 7-((4-((((4-((6,8-disulfo-2-naphthalenyl)azo)-2-methoxy-5-methylphenyl)amino)carbonyl)amino)-2-methoxy-5-methylphenyl)azo)-, tetrasodium salt
  • 1,3-Naphthalenedisulfonic acid, 7-(2-(4-((((4-(2-(6,8-disulfo-2-naphthalenyl)diazenyl)-2-methoxy-5-methylphenyl)amino)carbonyl)amino)-2-methoxy-5-methylphenyl)diazenyl)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 96446-42-3

System Generated Number

  • 0096446423

Molecular Formulas

Molecular Formula

  • C37-H32-N6-O15-S4.4Na

Molecular Formula Fragments

  • C37-H32-N6-O15-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C37H32N6O15S4.4Na/c1-19-10-32(43-41-24-8-6-22-12-26(60(48,49)50)16-36(28(22)14-24)62(54,55)56)34(58-4)17-29(19)38-37(44)39-31-9-20(2)30(18-33(31)57-3)42-40-23-7-5-21-11-25(59(45,46)47)15-35(27(21)13-23)61(51,52)53;;;;/h5-18H,1-4H3,(H2,38,39,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4/b42-40+,43-41+;;;;

InChIKey

SMHWQKMWYMTYSD-INRNMLHDSA-J

Smiles

S(=O)(=O)(c1cc(S(=O)(=O)[O-])cc2c1cc(/N=N/c1c(cc(NC(=O)Nc3c(cc(/N=N/c4cc5c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])cc5cc4)c(c3)C)OC)c(c1)C)OC)cc2)[O-].[Na+].[Na+].[Na+].[Na+]