5-chloromaleylacetate

Properties Image MNX_ID MNXM8167 reference metacycM:CPD-10634 formula C6H3ClO5 global charge -2 mol weight 190.538 InChIKey SCSZJXOTAAUHEL-UPHRSURJSA-L InChI InChI=1S/C6H5ClO5/c7-5(6(11)12)3(8)1-2-4(9)10/h1-2,5H,(H,9,10)(H,11,12)/p-2/b2-1- SMILES O=C([O-])/C=C\C(=O)C(Cl)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C6H5ClO5/c7-5(6(11)12)3(8)1-2-4(9)10/h1-2,5H,(H,9,10)(H,11,12)/b2-1-/t5? SMILES (mnx) [CH:1](=[CH:2]\[C:4](=[O:9])[OH:10])\[C:3]([CH:5]([C:6](=[O:11])[OH:12])[Cl:7])=[O:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 6 in models (compartimentalized) 0