4-methylbenzenesulfonate; (Z)-1-(3-methylbenzothiazol-2-yl)prop-1-en-2-ol
Molecular Formula:
C
18
H
19
NO
4
S
2
InChI:
InChI=1/C11H11NOS.C7H8O3S/c1-8(13)7-11-12(2)9-5-3-4-6-10(9)14-11;1-6-2-4-7(5-3-6)11(8,9)10/h3-7H,1-2H3;2-5H,1H3,(H,8,9,10)/fC11H12NOS.C7H7O3S/h13H;/q+1;-1/b8-7-;
InChIKey:
InChIKey=LGKABYASJBGZGX-WKSANVIJDP
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(=CC1=[N+](C2=CC=CC=C2S1)C)O
Names:
4-methylbenzenesulfonate; (Z)-1-(3-methylbenzothiazol-2-yl)prop-1-en-2-ol
Registries:
PubChem CID 5717835
PubChem ID 3297118