| Properties | Image |
|---|
| MNX_ID | MNXM1180456 |
 |
| reference | envipathM:...a3c54d595871 |
| formula | C12H12Cl4O3 |
| global charge | 0 |
| mol weight | 346.037 |
| InChIKey | WJEISIYAJLUCGP-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl4O3/c13-6-2-5-9(17)3-1-4(8-7(3)19-8)11(9,18)10(6,14)12(5,15)16/h3-8,17-18H,1-2H2 |
| SMILES | OC12C3CC(C4OC43)C1(O)C1(Cl)C(Cl)CC2C1(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O3/c13-6-2-5-9(17)3-1-4(8-7(3)19-8)11(9,18)10(6,14)12(5,15)16/h3-8,17-18H,1-2H2/t3?,4?,5?,6?,7?,8?,9?,10?,11? |
 |
| SMILES (mnx) | [CH2:1]1[CH:3]2[CH:7]3[CH:8]([CH:4]1[C:11]1([OH:18])[C:9]2([OH:17])[CH:5]2[CH2:2][CH:6]([Cl:13])[C:10]1([Cl:14])[C:12]2([Cl:15])[Cl:16])[O:19]3 |
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