| Properties | Image |
|---|
| MNX_ID | MNXM1170649 |
 |
| reference | envipathM:...19c6c7787dba |
| formula | C12H12Cl4O5 |
| global charge | 0 |
| mol weight | 378.035 |
| InChIKey | JMRSTOUQGICKGB-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl4O5/c13-5-6(14)12(20)9(15)10(5,16)4-2-1-3(11(4,12)19)8(18)21-7(2)17/h2-6,8-9,18-20H,1H2 |
| SMILES | O=C1OC(O)C2CC1C1C3(Cl)C(Cl)C(Cl)C(O)(C3Cl)C21O |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O5/c13-5-6(14)12(20)9(15)10(5,16)4-2-1-3(11(4,12)19)8(18)21-7(2)17/h2-6,8-9,18-20H,1H2/t2?,3?,4?,5?,6?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:2]2[CH:4]3[C:10]4([Cl:16])[CH:5]([Cl:13])[CH:6]([Cl:14])[C:12]([OH:20])([CH:9]4[Cl:15])[C:11]3([OH:19])[CH:3]1[CH:8]([OH:18])[O:21][C:7]2=[O:17] |
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