| Properties | Image |
|---|
| MNX_ID | MNXM1187786 |
 |
| reference | envipathM:...35280126bd68 |
| formula | C12H11Cl3O4 |
| global charge | 0 |
| mol weight | 325.575 |
| InChIKey | CFQCISXRADAUKP-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H11Cl3O4/c13-8-11(15)2-10(14,9(16)19-8)7-3-1-4(12(7,11)17)6-5(3)18-6/h3-8,17H,1-2H2 |
| SMILES | O=C1OC(Cl)C2(Cl)CC1(Cl)C1C3CC(C4OC34)C12O |
MNX internals
| InChI (mnx) | InChI=1/C12H11Cl3O4/c13-8-11(15)2-10(14,9(16)19-8)7-3-1-4(12(7,11)17)6-5(3)18-6/h3-8,17H,1-2H2/t3?,4?,5?,6?,7?,8?,10?,11?,12? |
 |
| SMILES (mnx) | [CH2:1]1[CH:3]2[CH:5]3[CH:6]([CH:4]1[C:12]1([OH:17])[CH:7]2[C:10]2([Cl:14])[CH2:2][C:11]1([Cl:15])[CH:8]([Cl:13])[O:19][C:9]2=[O:16])[O:18]3 |
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