| Properties | Image |
|---|
| MNX_ID | MNXM1194060 |
 |
| reference | envipathM:...8af1a3d98958 |
| formula | C12H11Cl5O2 |
| global charge | 0 |
| mol weight | 364.483 |
| InChIKey | CBPHRXWJUIIAOO-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H11Cl5O2/c13-4-8-10(18)3-1-2(5-6(3)19-5)7(10)11(15,9(4)14)12(8,16)17/h2-9,18H,1H2 |
| SMILES | OC12C3CC(C4OC43)C1C1(Cl)C(Cl)C(Cl)C2C1(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H11Cl5O2/c13-4-8-10(18)3-1-2(5-6(3)19-5)7(10)11(15,9(4)14)12(8,16)17/h2-9,18H,1H2/t2?,3?,4?,5?,6?,7?,8?,9?,10?,11? |
 |
| SMILES (mnx) | [CH2:1]1[CH:2]2[CH:5]3[CH:6]([CH:3]1[C:10]1([OH:18])[CH:7]2[C:11]2([Cl:15])[CH:9]([Cl:14])[CH:4]([Cl:13])[CH:8]1[C:12]2([Cl:16])[Cl:17])[O:19]3 |
|