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Substance Name: Benzoxazolium, 2-(3-(5-chloro-1-ethyl-1,3-dihydro-3-(2-(4-morpholinyl)ethyl)-2H-benzimidazol-2-ylidene)-1-propen-1-yl)-3-ethyl-, iodide (1:1)
RN: 63059-43-8
InChIKey: FDZJJIPJNDQFMS-UHFFFAOYSA-M

Molecular Formula

  • C27-H32-Cl-N4-O2.I

Molecular Weight

  • 606.929
 
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Names and Synonyms

Synonym

  • EINECS 263-819-4

Systematic Names

  • 2-(3-(5-Chloro-1-ethyl-1,3-dihydro-3-(2-morpholinoethyl)-2H-benzimidazol-2-ylidene)prop-1-enyl)-3-ethylbenzoxazolium iodide
  • Benzoxazolium, 2-(3-(5-chloro-1-ethyl-1,3-dihydro-3-(2-(4-morpholinyl)ethyl)-2H-benzimidazol-2-ylidene)-1-propen-1-yl)-3-ethyl-, iodide (1:1)
  • Benzoxazolium, 2-(3-(5-chloro-1-ethyl-1,3-dihydro-3-(2-(4-morpholinyl)ethyl)-2H-benzimidazol-2-ylidene)-1-propenyl)-3-ethyl-, iodide

Registry Numbers

CAS Registry Number

  • 63059-43-8

Other Registry Number

  • 34394-50-8

System Generated Number

  • 0063059438

Molecular Formulas

Molecular Formula

  • C27-H32-Cl-N4-O2.I

Molecular Formula Fragments

  • C27-H32-Cl-N4-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C27H32ClN4O2.HI/c1-3-30-22-13-12-21(28)20-24(22)32(15-14-29-16-18-33-19-17-29)26(30)10-7-11-27-31(4-2)23-8-5-6-9-25(23)34-27;/h5-13,20H,3-4,14-19H2,1-2H3;1H/q+1;/p-1

InChIKey

FDZJJIPJNDQFMS-UHFFFAOYSA-M

Smiles

Clc1cc2N(CCN3CCOCC3)C(=C\C=C/c3oc4ccccc4[n+]3CC)\N(c2cc1)CC.[IH-]