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Substance Name: Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-2(3H)-benzothiazolylidene)methyl)-1-buten-1-yl)-5,6-dimethyl-, iodide (1:1)
RN: 63870-45-1
InChIKey: OZPMNWSLSANVJN-UHFFFAOYSA-M

Molecular Formula

  • C25-H29-N2-O-S.I

Molecular Weight

  • 532.483
 
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Names and Synonyms

Synonyms

  • Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-2(3H)-benzothiazolylidene)methyl)-1-butenyl)-5,6-dimethyl-, iodide
  • EINECS 264-534-8

Systematic Names

  • 3-Ethyl-2-(2-((3-ethyl-3H-benzothiazol-2-ylidene)methyl)but-1-enyl)-5,6-dimethylbenzoxazolium iodide
  • Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-2(3H)-benzothiazolylidene)methyl)-1-buten-1-yl)-5,6-dimethyl-, iodide (1:1)
  • Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-2(3H)-benzothiazolylidene)methyl)-1-butenyl)-5,6-dimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 63870-45-1

System Generated Number

  • 0063870451

Molecular Formulas

Molecular Formula

  • C25-H29-N2-O-S.I

Molecular Formula Fragments

  • C25-H29-N2-O-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C25H29N2OS.HI/c1-6-19(16-25-27(8-3)20-11-9-10-12-23(20)29-25)15-24-26(7-2)21-13-17(4)18(5)14-22(21)28-24;/h9-16H,6-8H2,1-5H3;1H/q+1;/p-1

InChIKey

OZPMNWSLSANVJN-UHFFFAOYSA-M

Smiles

o1c([n+](c2c1cc(c(c2)C)C)CC)\C=C(\CC)\C=C1/Sc2c(N1CC)cccc2.[IH-]