| Properties | Image |
|---|
| MNX_ID | MNXM1169970 |
 |
| reference | envipathM:...658aee49d766 |
| formula | C12H10Cl4O5 |
| global charge | 0 |
| mol weight | 376.019 |
| InChIKey | DXOYEDBYESBOQC-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H10Cl4O5/c13-5-2-9(15)8(14)10(5,16)12(20)4-1-3(11(9,12)19)6(17)21-7(4)18/h2-4,7-8,18-20H,1H2 |
| SMILES | O=C1OC(O)C2CC1C1(O)C3(Cl)C=C(Cl)C(Cl)(C3Cl)C21O |
MNX internals
| InChI (mnx) | InChI=1/C12H10Cl4O5/c13-5-2-9(15)8(14)10(5,16)12(20)4-1-3(11(9,12)19)6(17)21-7(4)18/h2-4,7-8,18-20H,1H2/t3?,4?,7?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:3]2[C:6](=[O:17])[O:21][CH:7]([OH:18])[CH:4]1[C:12]1([OH:20])[C:10]3([Cl:16])[C:5]([Cl:13])=[CH:2][C:9]([Cl:15])([CH:8]3[Cl:14])[C:11]21[OH:19] |
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