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Substance Name: Benzoxazolium, 2-methyl-5-phenyl-3-(3-sulfopropyl)-, inner salt
RN: 66142-15-2
InChIKey: DKMBQSTXNOURJD-UHFFFAOYSA-N

Molecular Formula

  • C17-H17-N-O4-S

Molecular Weight

  • 331.39
 
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Names and Synonyms

Synonyms

  • 2-Methyl-5-phenyl-3-(3-sulfopropyl)benzoxazolium inner salt
  • Anhydro-2-methyl-5-phenyl-3-(3-sulfopropyl)benzoxazolium hydroxide
  • EINECS 266-175-2

Systematic Names

  • 2-Methyl-5-phenyl-3-(3-sulphonatopropyl)benzoxazolium
  • Benzoxazolium, 2-methyl-5-phenyl-3-(3-sulfopropyl)-, inner salt

Registry Numbers

CAS Registry Number

  • 66142-15-2

System Generated Number

  • 0066142152

Structure Descriptors

InChI

1S/C17H17NO4S/c1-13-18(10-5-11-23(19,20)21)16-12-15(8-9-17(16)22-13)14-6-3-2-4-7-14/h2-4,6-9,12H,5,10-11H2,1H3

InChIKey

DKMBQSTXNOURJD-UHFFFAOYSA-N

Smiles

O=S(=O)([O-])CCC[n+]1c2c(oc1C)ccc(c1ccccc1)c2