2-(2-carboxyphenyl)sulfinyl-5-methoxy-benzoic acid dihydrate
Molecular Formula:
C
15
H
16
O
8
S
InChI:
InChI=1/C15H12O6S.2H2O/c1-21-9-6-7-13(11(8-9)15(18)19)22(20)12-5-3-2-4-10(12)14(16)17;;/h2-8H,1H3,(H,16,17)(H,18,19);2*1H2/f/h16,18H;;
InChIKey:
InChIKey=ZFNNPRKRGOAQOF-WRIVHSAJCV
SMILES:
COC1=CC(=C(C=C1)S(=O)C2=CC=CC=C2C(=O)O)C(=O)O.O.O
Names:
2-(2-carboxyphenyl)sulfinyl-5-methoxy-benzoic acid dihydrate
Registries:
PubChem CID 2824902
PubChem ID 3285572
