Benzoxazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt

CAS Registry Number®

54443-97-9

CAS Name

Benzoxazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt

Molecular Formula

C11H13NO4S

Cite this Page

Benzoxazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54443-97-9 (retrieved 2025-01-31) (CAS RN: 54443-97-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H13NO4S/c1-9-12(7-4-8-17(13,14)15)10-5-2-3-6-11(10)16-9/h2-3,5-6H,4,7-8H2,1H3

InChIKey

InChIKey=VGMUYGXTYXTNNL-UHFFFAOYSA-N

SMILES

C(CCS(=O)(=O)[O-])[N+]=1C=2C(OC1C)=CC=CC2

Canonical SMILES

O=S(=O)([O-])CCC[N+]=1C=2C=CC=CC2OC1C

Other Names for this Substance

  • Benzoxazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt
  • Benzoxazolium, 2-methyl-3-(3-sulfopropyl)-, hydroxide, inner salt
  • Anhydro-2-methyl-3-(γ-sulfopropyl)-benzoxazolium hydroxide