3-(6-methoxy-2,5-dimethyl-benzothiazol-3-yl)propane-1-sulfonate
Molecular Formula:
C
13
H
17
NO
4
S
2
InChI:
InChI=1/C13H17NO4S2/c1-9-7-11-13(8-12(9)18-3)19-10(2)14(11)5-4-6-20(15,16)17/h7-8H,4-6H2,1-3H3
InChIKey:
InChIKey=KUKSDGDMBLTVEW-UHFFFAOYAN
SMILES:
CC1=CC2=C(C=C1OC)SC(=[N+]2CCCS(=O)(=O)[O-])C
Names:
3-(6-methoxy-2,5-dimethyl-benzothiazol-3-yl)propane-1-sulfonate
Registries:
PubChem CID 114281
PubChem ID 10236278