| Properties | Image |
|---|
| MNX_ID | MNXM1177773 |
 |
| reference | envipathM:...5e91fa343014 |
| formula | C12H11Cl5O2 |
| global charge | 0 |
| mol weight | 364.483 |
| InChIKey | BNARZSIKQRRYQW-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H11Cl5O2/c13-5-4-3-2-1-10(18,9-6(2)19-9)7(3)11(15,8(5)14)12(4,16)17/h2-9,18H,1H2 |
| SMILES | OC12CC(C3OC31)C1C3C(Cl)C(Cl)C(Cl)(C12)C3(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H11Cl5O2/c13-5-4-3-2-1-10(18,9-6(2)19-9)7(3)11(15,8(5)14)12(4,16)17/h2-9,18H,1H2/t2?,3?,4?,5?,6?,7?,8?,9?,10?,11? |
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| SMILES (mnx) | [CH2:1]1[CH:2]2[CH:3]3[CH:4]4[CH:5]([Cl:13])[CH:8]([Cl:14])[C:11]([Cl:15])([CH:7]3[C:10]1([OH:18])[CH:9]1[CH:6]2[O:19]1)[C:12]4([Cl:16])[Cl:17] |
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