3-ethyl-2-methyl-benzothiazole; sulfonatooxyethane
Molecular Formula:
C
12
H
17
NO
4
S
2
InChI:
InChI=1/C10H12NS.C2H6O4S/c1-3-11-8(2)12-10-7-5-4-6-9(10)11;1-2-6-7(3,4)5/h4-7H,3H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1/fC10H12NS.C2H5O4S/qm;-1
InChIKey:
InChIKey=SEDPVLBQLWLFFH-ODWKAUEHCJ
SMILES:
CC[N+]1=C(SC2=CC=CC=C21)C.CCOS(=O)(=O)[O-]
Names:
3-ethyl-2-methyl-benzothiazole; sulfonatooxyethane
Registries:
PubChem CID 88029
PubChem ID 10222798