| Properties | Image |
|---|
| MNX_ID | MNXM1177482 |
 |
| reference | envipathM:...0ffa37b6f566 |
| formula | C12H13Cl2O4 |
| global charge | -1 |
| mol weight | 292.138 |
| InChIKey | DZWHEELYFUIKQB-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H14Cl2O4/c13-7-1-4-3-12(7,14)9-6(11(17)18)2-5(8(4)9)10(15)16/h1,4-6,8-9,11,17-18H,2-3H2,(H,15,16)/p-1 |
| SMILES | O=C([O-])C1CC(C(O)O)C2C1C1C=C(Cl)C2(Cl)C1 |
MNX internals
| InChI (mnx) | InChI=1/C12H14Cl2O4/c13-7-1-4-3-12(7,14)9-6(11(17)18)2-5(8(4)9)10(15)16/h1,4-6,8-9,11,17-18H,2-3H2,(H,15,16)/t4?,5?,6?,8?,9?,12? |
 |
| SMILES (mnx) | [CH:1]1=[C:7]([Cl:13])[C:12]2([Cl:14])[CH2:3][CH:4]1[CH:8]1[CH:5]([C:10](=[O:15])[OH:16])[CH2:2][CH:6]([CH:11]([OH:17])[OH:18])[CH:9]12 |
|