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Substance Name: 3H-Pyrrolo(2,3-b)pyridinium, 2-(2-(1,2-diphenyl-1H-indol-3-yl)ethenyl)-1,3,3-trimethyl-, 4-methylbenzenesulfonate (1:1)
RN: 63123-18-2
InChIKey: RHYBTAZGAJJDLU-UHFFFAOYSA-M

Molecular Formula

  • C32-H28-N3.C7-H7-O3-S

Molecular Weight

  • 625.789
 
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Names and Synonyms

Synonym

  • EINECS 263-868-1

Systematic Names

  • 2-(2-(1,2-Diphenyl-1H-indol-3-yl)vinyl)-1,3,3-trimethyl-3H-pyrrolo(2,3-b)pyridinium toluene-p-sulphonate
  • 3H-Pyrrolo(2,3-b)pyridinium, 2-(2-(1,2-diphenyl-1H-indol-3-yl)ethenyl)-1,3,3-trimethyl-, 4-methylbenzenesulfonate (1:1)
  • 3H-Pyrrolo(2,3-b)pyridinium, 2-(2-(1,2-diphenyl-1H-indol-3-yl)ethenyl)-1,3,3-trimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)

Registry Numbers

CAS Registry Number

  • 63123-18-2

System Generated Number

  • 0063123182

Molecular Formulas

Molecular Formula

  • C32-H28-N3.C7-H7-O3-S

Molecular Formula Fragments

  • C32-H28-N3
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C32H28N3.C7H8O3S/c1-32(2)27-18-12-22-33-31(27)34(3)29(32)21-20-26-25-17-10-11-19-28(25)35(24-15-8-5-9-16-24)30(26)23-13-6-4-7-14-23;1-6-2-4-7(5-3-6)11(8,9)10/h4-22H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChIKey

RHYBTAZGAJJDLU-UHFFFAOYSA-M

Smiles

n1(c(c(\C=C/C2=[N+](c3ncccc3C2(C)C)C)c2c1cccc2)c1ccccc1)c1ccccc1.c1cc(ccc1C)S(=O)(=O)[O-]