Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1c(c(O)c(Cl)cc1Cl)Cc2c(O)c(Cl)cc(Cl)c2Cl |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1c(Cl)cc(Cl)c(Cl)c1Cc2c(O)c(Cl)cc(Cl)c2Cl |
SMILES | CACTVS | 3.341 | Oc1c(Cl)cc(Cl)c(Cl)c1Cc2c(O)c(Cl)cc(Cl)c2Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(c(c(c(c1Cl)Cl)Cc2c(c(cc(c2Cl)Cl)Cl)O)O)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1c(c(c(c(c1Cl)Cl)Cc2c(c(cc(c2Cl)Cl)Cl)O)O)Cl |
InChI | InChI | 1.03 | InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2 |
InChIKey | InChI | 1.03 | ACGUYXCXAPNIKK-UHFFFAOYSA-N |