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Substance Name: Benzoxazolium, 3-ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl)-, iodide (1:1)
RN: 63123-28-4
InChIKey: XWMRSYIAYNAIJX-UHFFFAOYSA-M

Molecular Formula

  • C19-H23-N2-O.I

Molecular Weight

  • 422.304
 
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Names and Synonyms

Synonym

  • EINECS 263-876-5

Systematic Names

  • 3-Ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)vinyl)benzoxazolinium iodide
  • Benzoxazolium, 3-ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl)-, iodide
  • Benzoxazolium, 3-ethyl-2-(2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl)-, iodide (1:1)

Registry Numbers

CAS Registry Number

  • 63123-28-4

System Generated Number

  • 0063123284

Molecular Formulas

Molecular Formula

  • C19-H23-N2-O.I

Molecular Formula Fragments

  • C19-H23-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C19H23N2O.HI/c1-5-20-14(3)13-16(15(20)4)11-12-19-21(6-2)17-9-7-8-10-18(17)22-19;/h7-13H,5-6H2,1-4H3;1H/q+1;/p-1

InChIKey

XWMRSYIAYNAIJX-UHFFFAOYSA-M

Smiles

c1cc2oc(\C=C/c3c(n(CC)c(c3)C)C)[n+](c2cc1)CC.[IH-]