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Substance Name: Benzoselenazolium, 5-methoxy-2-((5-methyl-3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-3-(3-sulfopropyl)-, inner salt, sodium salt (1:1)
RN: 70679-43-5
InChIKey: ATCRRTZLWREEPW-UHFFFAOYSA-N

Molecular Formula

  • C23-H26-N2-O7-S2-Se2.Na

Molecular Weight

  • 687.5074
 
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Names and Synonyms

Synonym

  • 5-Methoxy-2-((5-methyl-3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-3-(3-sulfopropyl)benzoselenazolium, hydroxide, inner salt, sodium salt

Systematic Names

  • Benzoselenazolium, 5-methoxy-2-((5-methyl-3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-3-(3-sulfopropyl)-, inner salt, sodium salt
  • Benzoselenazolium, 5-methoxy-2-((5-methyl-3-(3-sulfopropyl)-2(3H)-benzoselenazolylidene)methyl)-3-(3-sulfopropyl)-, inner salt, sodium salt (1:1)

Registry Numbers

CAS Registry Number

  • 70679-43-5

System Generated Number

  • 0070679435

Molecular Formulas

Molecular Formula

  • C23-H26-N2-O7-S2-Se2.Na

Molecular Formula Fragments

  • C23-H26-N2-O7-S2-Se2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C23H26N2O7S2Se2.Na/c1-16-5-7-20-18(13-16)24(9-3-11-33(26,27)28)22(35-20)15-23-25(10-4-12-34(29,30)31)19-14-17(32-2)6-8-21(19)36-23;/h5-8,13-15H,3-4,9-12H2,1-2H3,(H-,26,27,28,29,30,31);/q;+1

InChIKey

ATCRRTZLWREEPW-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)N(/C(=C\c3[n+](c4cc(ccc4[se]3)OC)CCCS(=O)(=O)[O-])/[Se]2)CCCS(=O)(=O)O.[Na+]