| Properties | Image |
|---|
| MNX_ID | MNXM1181835 |
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| reference | envipathM:...14ee09959a67 |
| formula | C12H10Cl5O6 |
| global charge | -1 |
| mol weight | 427.471 |
| InChIKey | FCXQSWPGSLZWJE-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H11Cl5O6/c13-8-7-9(22)6(11(15,10(8)14)12(7,16)17)3(1-4(19)20)23-5(21)2-18/h3,6-7,9,18,22H,1-2H2,(H,19,20)/p-1 |
| SMILES | O=C([O-])CC(OC(=O)CO)C1C(O)C2C(Cl)=C(Cl)C1(Cl)C2(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H11Cl5O6/c13-8-7-9(22)6(11(15,10(8)14)12(7,16)17)3(1-4(19)20)23-5(21)2-18/h3,6-7,9,18,22H,1-2H2,(H,19,20)/t3?,6?,7?,9?,11? |
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| SMILES (mnx) | [CH2:1]([CH:3]([CH:6]1[CH:9]([OH:22])[CH:7]2[C:8]([Cl:13])=[C:10]([Cl:14])[C:11]1([Cl:15])[C:12]2([Cl:16])[Cl:17])[O:23][C:5]([CH2:2][OH:18])=[O:21])[C:4](=[O:19])[OH:20] |
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