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Substance Name: 7-Benzothiazolesulfonic acid, 2-(4-aminophenyl)-6-methyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)
RN: 80890-42-2
InChIKey: QDDVIQOJFQOVJW-UHFFFAOYSA-N

Molecular Formula

  • C14-H12-N2-O3-S2.C6-H15-N-O3

Molecular Weight

  • 469.58
 
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Names and Synonyms

Synonyms

  • 7-Benzothiazolesulfonic acid, 2(-p-aminophenyl)-6-methyl-, triethanolamine salt
  • EINECS 279-616-9

Systematic Names

  • 2-(4-Aminophenyl)-6-methylbenzothiazole-7-sulphonic acid, compoundwith 2,2',2''-nitrilotris(ethanol) (1:1)
  • 7-Benzothiazolesulfonic acid, 2-(4-aminophenyl)-6-methyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)

Registry Numbers

CAS Registry Number

  • 80890-42-2

System Generated Number

  • 0080890422

Molecular Formulas

Molecular Formula

  • C14-H12-N2-O3-S2.C6-H15-N-O3

Molecular Formula Fragments

  • C14-H12-N2-O3-S2
  • C6-H15-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C14H12N2O3S2.C6H15NO3/c1-8-2-7-11-12(13(8)21(17,18)19)20-14(16-11)9-3-5-10(15)6-4-9;8-4-1-7(2-5-9)3-6-10/h2-7H,15H2,1H3,(H,17,18,19);8-10H,1-6H2

InChIKey

QDDVIQOJFQOVJW-UHFFFAOYSA-N

Smiles

N(CCO)(CCO)CCO.s1c(nc2c1c(c(cc2)C)S(=O)(=O)O)c1ccc(cc1)N