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Substance Name: Benzoxazolium, 3-methyl-2-(3-(3-methyl-2(3H)-benzoxazolylidene)-1-propen-1-yl)-, 4-methylbenzenesulfonate (1:1)
RN: 41503-58-6
InChIKey: YWXXFCTUEZUPQE-UHFFFAOYSA-M

Molecular Formula

  • C19-H17-N2-O2.C7-H7-O3-S

Molecular Weight

  • 476.551
 
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Names and Synonyms

Synonym

  • EINECS 255-414-6

Systematic Names

  • 3-Methyl-2-(3-(3-methyl-3H-benzoxazol-2-ylidene)prop-1-enyl)benzoxazolium p-toluenesulphonate
  • Benzoxazolium, 3-methyl-2-(3-(3-methyl-2(3H)-benzoxazolylidene)-1-propen-1-yl)-, 4-methylbenzenesulfonate (1:1)
  • Benzoxazolium, 3-methyl-2-(3-(3-methyl-2(3H)-benzoxazolylidene)-1-propenyl)-, salt with 4-methylbenzenesulfonic acid (1:1)

Registry Numbers

CAS Registry Number

  • 41503-58-6

System Generated Number

  • 0041503586

Molecular Formulas

Molecular Formula

  • C19-H17-N2-O2.C7-H7-O3-S

Molecular Formula Fragments

  • C19-H17-N2-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H17N2O2.C7H8O3S/c1-20-14-8-3-5-10-16(14)22-18(20)12-7-13-19-21(2)15-9-4-6-11-17(15)23-19;1-6-2-4-7(5-3-6)11(8,9)10/h3-13H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChIKey

YWXXFCTUEZUPQE-UHFFFAOYSA-M

Smiles

c1(ccc(C)cc1)S(=O)(=O)[O-].[n+]1(c(oc2c1cccc2)\C=C\C=C1\Oc2c(N1C)cccc2)C