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Substance Name: Benzenesulfonic acid, 3-(2-(4-(ethyl(phenylmethyl)amino)phenyl)diazenyl)-4-((4-methylphenyl)sulfonyl)-
RN: 68400-40-8
InChIKey: IJJGDLXWIBIJMW-QVIHXGFCSA-N

Molecular Formula

  • C28-H27-N3-O5-S2

Molecular Weight

  • 549.669
 
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Names and Synonyms

Synonyms

  • 3-((4-(Ethyl(phenylmethyl)amino)phenyl)azo)-4-((4-methylphenyl)sulfonyl)benzenesulfonic acid
  • EINECS 270-029-3

Systematic Names

  • 3-((4-(Ethyltolylamino)phenyl)azo)-4-(4-tolylsulphonyl)benzenesulphonic acid
  • Benzenesulfonic acid, 3-((4-(ethyl(phenylmethyl)amino)phenyl)azo)-4-((4-methylphenyl)sulfonyl)-
  • Benzenesulfonic acid, 3-(2-(4-(ethyl(phenylmethyl)amino)phenyl)diazenyl)-4-((4-methylphenyl)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 68400-40-8

System Generated Number

  • 0068400408

Structure Descriptors

InChI

1S/C28H27N3O5S2/c1-3-31(20-22-7-5-4-6-8-22)24-13-11-23(12-14-24)29-30-27-19-26(38(34,35)36)17-18-28(27)37(32,33)25-15-9-21(2)10-16-25/h4-19H,3,20H2,1-2H3,(H,34,35,36)/b30-29+

InChIKey

IJJGDLXWIBIJMW-QVIHXGFCSA-N

Smiles

O=S(=O)(c1c(\N=N\c2ccc(N(Cc3ccccc3)CC)cc2)cc(S(=O)(=O)O)cc1)c1ccc(cc1)C