compound 0085791

Properties Image MNX_ID MNXM1179433 reference envipathM:...f3fe9cd1667b formula C12H10Cl4O4 global charge 0 mol weight 360.02 InChIKey YDKLZQKGQGXSEV-UHFFFAOYSA-N InChI InChI=1S/C12H10Cl4O4/c13-9-10(14)12(16)3-11(9,15)7-4(18)1-5(8(7)12)20-6(19)2-17/h5,7-8,17H,1-3H2 SMILES O=C(CO)OC1CC(=O)C2C1C1(Cl)CC2(Cl)C(Cl)=C1Cl MNX internals InChI (mnx) InChI=1/C12H10Cl4O4/c13-9-10(14)12(16)3-11(9,15)7-4(18)1-5(8(7)12)20-6(19)2-17/h5,7-8,17H,1-3H2/t5?,7?,8?,11?,12? SMILES (mnx) [CH2:1]1[C:4](=[O:18])[CH:7]2[CH:8]([CH:5]1[O:20][C:6]([CH2:2][OH:17])=[O:19])[C:12]1([Cl:16])[CH2:3][C:11]2([Cl:15])[C:9]([Cl:13])=[C:10]1[Cl:14]

Parent-child relations graph

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