compound 0284643

Properties Image MNX_ID MNXM1180251 reference envipathM:...1377d08a4344 formula C11H9ClO4 global charge -2 mol weight 240.642 InChIKey TZXDEPMBYHWULA-UHFFFAOYSA-L InChI InChI=1S/C11H11ClO4/c1-6(10(13)14)9(11(15)16)7-2-4-8(12)5-3-7/h2-6,9H,1H3,(H,13,14)(H,15,16)/p-2 SMILES CC(C(=O)[O-])C(C(=O)[O-])C1=CC=C(Cl)C=C1 MNX internals InChI (mnx) InChI=1/C11H11ClO4/c1-6(10(13)14)9(11(15)16)7-2-4-8(12)5-3-7/h2-6,9H,1H3,(H,13,14)(H,15,16)/t6?,9? SMILES (mnx) [CH3:1][CH:6]([CH:9]([C:7]1=[CH:3][CH:5]=[C:8]([Cl:12])[CH:4]=[CH:2]1)[C:11](=[O:15])[OH:16])[C:10](=[O:13])[OH:14]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0