| Properties | Image |
|---|
| MNX_ID | MNXM1195879 |
 |
| reference | envipathM:...b59a84f40aa4 |
| formula | C12H11Cl3O4 |
| global charge | 0 |
| mol weight | 325.575 |
| InChIKey | OMFKZDUHKVNYOG-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H11Cl3O4/c13-4-2-10(15)8(14)11(4,17)7-9(16)1-3(12(7,10)18)5-6(9)19-5/h2-3,5-8,16-18H,1H2 |
| SMILES | OC12CC(C3OC31)C1(O)C2C2(O)C(Cl)=CC1(Cl)C2Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H11Cl3O4/c13-4-2-10(15)8(14)11(4,17)7-9(16)1-3(12(7,10)18)5-6(9)19-5/h2-3,5-8,16-18H,1H2/t3?,5?,6?,7?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:3]2[CH:5]3[CH:6]([C:9]1([OH:16])[CH:7]1[C:11]4([OH:17])[C:4]([Cl:13])=[CH:2][C:10]([Cl:15])([CH:8]4[Cl:14])[C:12]21[OH:18])[O:19]3 |
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