| Properties | Image |
|---|
| MNX_ID | MNXM1170830 |
 |
| reference | envipathM:...63a4b8145969 |
| formula | C12H11Cl4O5 |
| global charge | -1 |
| mol weight | 377.027 |
| InChIKey | NZQVIIPODORSRQ-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H12Cl4O5/c13-6-3-5-7(4(1-2-17)8(18)10(20)21)9(19)11(6,14)12(5,15)16/h3-5,7-8,17-18H,1-2H2,(H,20,21)/p-1 |
| SMILES | O=C([O-])C(O)C(CCO)C1C(=O)C2(Cl)C(Cl)=CC1C2(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H12Cl4O5/c13-6-3-5-7(4(1-2-17)8(18)10(20)21)9(19)11(6,14)12(5,15)16/h3-5,7-8,17-18H,1-2H2,(H,20,21)/t4?,5?,7?,8?,11? |
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| SMILES (mnx) | [CH2:1]([CH2:2][OH:17])[CH:4]([CH:7]1[CH:5]2[CH:3]=[C:6]([Cl:13])[C:11]([Cl:14])([C:9]1=[O:19])[C:12]2([Cl:15])[Cl:16])[CH:8]([C:10](=[O:20])[OH:21])[OH:18] |
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