2,3-dimethylbenzothiazole; 4-methylbenzenesulfonate
Molecular Formula:
C
16
H
17
NO
3
S
2
InChI:
InChI=1/C9H10NS.C7H8O3S/c1-7-10(2)8-5-3-4-6-9(8)11-7;1-6-2-4-7(5-3-6)11(8,9)10/h3-6H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/fC9H10NS.C7H7O3S/qm;-1
InChIKey:
InChIKey=GYHJFWZSCIYJKD-MSEVKUNHCG
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=CC=CC=C2S1)C
Names:
2,3-dimethylbenzothiazole; 4-methylbenzenesulfonate
Registries:
PubChem CID 102307
PubChem ID 10232516