| Properties | Image |
|---|
| MNX_ID | MNXM1189951 |
 |
| reference | envipathM:...d75f48f7dbb2 |
| formula | C12H12Cl2O3 |
| global charge | 0 |
| mol weight | 275.131 |
| InChIKey | NTKDYTWLTTVKCM-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H12Cl2O3/c13-10-5-2-6(15)11(10,14)9-3-1-4(12(5,9)16)8-7(3)17-8/h3-5,7-10,16H,1-2H2 |
| SMILES | O=C1CC2C(Cl)C1(Cl)C1C3CC(C4OC34)C21O |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl2O3/c13-10-5-2-6(15)11(10,14)9-3-1-4(12(5,9)16)8-7(3)17-8/h3-5,7-10,16H,1-2H2/t3?,4?,5?,7?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:3]2[CH:7]3[CH:8]([CH:4]1[C:12]1([OH:16])[CH:5]4[CH2:2][C:6](=[O:15])[C:11]([Cl:14])([CH:9]21)[CH:10]4[Cl:13])[O:17]3 |
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