VUAgT 210
Molecular Formula:
C
18
H
14
Cl
2
NNaO
6
S
InChI:
InChI=1/C9H6ClNO3S.C9H9ClO3.Na/c10-5-2-1-3-6-8(5)11(4-7(12)13)9(14)15-6;1-6-4-7(10)2-3-8(6)13-5-9(11)12;/h1-3H,4H2,(H,12,13);2-4H,5H2,1H3,(H,11,12);/q;;+1/p-1/fC9H6ClNO3S.C9H8ClO3.Na/h12H;;/q;-1;m
InChIKey:
InChIKey=CQZWVRGYQSKFCX-VGQRWRABCE
SMILES:
CC1=C(C=CC(=C1)Cl)OCC(=O)[O-].C1=CC2=C(C(=C1)Cl)N(C(=O)S2)CC(=O)O.[Na+]
Names:
sodium; 2-(4-chloro-2-methyl-phenoxy)acetate; 2-(4-chloro-2-oxo-benzothiazol-3-yl)acetic acid
VUAgT 210
65280-19-5
Registries:
PubChem CID 47605
PubChem ID 186856