| Properties | Image |
|---|
| MNX_ID | MNXM1190569 |
 |
| reference | envipathM:...3d1b13c55302 |
| formula | C12H12Cl4O5 |
| global charge | 0 |
| mol weight | 378.035 |
| InChIKey | LARRAWRKITUVMF-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl4O5/c13-10(20)3-5-6(4-1-2-21-9(19)7(4)17)8(18)11(10,14)12(5,15)16/h4-7,17,20H,1-3H2 |
| SMILES | O=C1OCCC(C2C(=O)C3(Cl)C(O)(Cl)CC2C3(Cl)Cl)C1O |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O5/c13-10(20)3-5-6(4-1-2-21-9(19)7(4)17)8(18)11(10,14)12(5,15)16/h4-7,17,20H,1-3H2/t4?,5?,6?,7?,10?,11? |
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| SMILES (mnx) | [CH2:1]1[CH2:2][O:21][C:9](=[O:19])[CH:7]([OH:17])[CH:4]1[CH:6]1[CH:5]2[CH2:3][C:10]([Cl:13])([OH:20])[C:11]([Cl:14])([C:8]1=[O:18])[C:12]2([Cl:15])[Cl:16] |
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