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Substance Name: Benzoxazolium, 2-(2-ethoxy-1-buten-1-yl)-5-phenyl-3-(3-sulfobutyl)-, inner salt
RN: 63148-98-1
InChIKey: MELDWZHRDNMCFT-CAPFRKAQSA-N

Molecular Formula

  • C23-H27-N-O5-S

Molecular Weight

  • 429.534
 
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Names and Synonyms

Synonyms

  • Benzoxazolium, 2-(2-ethoxy-1-butenyl)-5-phenyl-3-(3-sulfobutyl)-, hydroxide, inner salt
  • EINECS 263-947-0

Systematic Names

  • 2-(2-Ethoxybut-1-enyl)-5-phenyl-3-(3-sulphonatobutyl)benzoxazolium
  • Benzoxazolium, 2-(2-ethoxy-1-buten-1-yl)-5-phenyl-3-(3-sulfobutyl)-, inner salt
  • Benzoxazolium, 2-(2-ethoxy-1-butenyl)-5-phenyl-3-(3-sulfobutyl)-, inner salt

Registry Numbers

CAS Registry Number

  • 63148-98-1

System Generated Number

  • 0063148981

Structure Descriptors

InChI

1S/C23H27NO5S/c1-4-20(28-5-2)16-23-24(14-13-17(3)30(25,26)27)21-15-19(11-12-22(21)29-23)18-9-7-6-8-10-18/h6-12,15-17H,4-5,13-14H2,1-3H3/b20-16+

InChIKey

MELDWZHRDNMCFT-CAPFRKAQSA-N

Smiles

O=S(=O)([O-])[C@@H](CC[n+]1c2c(oc1\C=C(\OCC)CC)ccc(c1ccccc1)c2)C