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Substance Name: 2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium sulphate (2:1)
RN: 83969-02-2
InChIKey: ORCKVSQVWDFSLI-UHFFFAOYSA-N

Molecular Formula

  • C20-H23-N4-O3.1/2O4-S

Molecular Weight

  • 830.9154
 
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Names and Synonyms

Synonym

  • EINECS 281-578-3

Systematic Name

  • 2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium sulphate (2:1)

Registry Numbers

CAS Registry Number

  • 83969-02-2

System Generated Number

  • 0083969022

Molecular Formulas

Molecular Formula

  • C20-H23-N4-O3.1/2O4-S

Molecular Formula Fragments

  • C20-H23-N4-O3
  • COMPONENT
  • O4-S

Structure Descriptors

InChI

1S/2C20H22N4O3.H2O4S/c2*1-20(2)17-11-15(24(25)26)7-10-18(17)23(3)19(20)13-22-21-12-14-5-8-16(27-4)9-6-14;1-5(2,3)4/h2*5-11,13H,12H2,1-4H3;(H2,1,2,3,4)

InChIKey

ORCKVSQVWDFSLI-UHFFFAOYSA-N

Smiles

CC1(C(=[N+](c2c1cc(cc2)[N+](=O)[O-])C)/C=N/NCc3ccc(cc3)OC)C.CC1(C(=[N+](c2c1cc(cc2)[N+](=O)[O-])C)/C=N/NCc3ccc(cc3)OC)C.[O-]S(=O)(=O)[O-]