Benzoxazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt

CAS Registry Number®

70615-15-5

CAS Name

Benzoxazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt

Molecular Formula

C12H15NO4S

Cite this Page

Benzoxazolium, 2,5-dimethyl-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=70615-15-5 (retrieved 2024-11-29) (CAS RN: 70615-15-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15NO4S/c1-9-4-5-12-11(8-9)13(10(2)17-12)6-3-7-18(14,15)16/h4-5,8H,3,6-7H2,1-2H3

InChIKey

InChIKey=ZKSJRECMNSQHIZ-UHFFFAOYSA-N

SMILES

C(CCS(=O)(=O)[O-])[N+]=1C=2C(OC1C)=CC=C(C)C2

Canonical SMILES

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

Other Names for this Substance

  • Benzoxazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt
  • Benzoxazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, hydroxide, inner salt

CAS INSIGHTSTM
Hourglass and a clock