Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1cc(cc(Cl)c1O)C(c2cc(Cl)c(O)c(Cl)c2)(C)C |
SMILES_CANONICAL | CACTVS | 3.370 | CC(C)(c1cc(Cl)c(O)c(Cl)c1)c2cc(Cl)c(O)c(Cl)c2 |
SMILES | CACTVS | 3.370 | CC(C)(c1cc(Cl)c(O)c(Cl)c1)c2cc(Cl)c(O)c(Cl)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)(c1cc(c(c(c1)Cl)O)Cl)c2cc(c(c(c2)Cl)O)Cl |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)(c1cc(c(c(c1)Cl)O)Cl)c2cc(c(c(c2)Cl)O)Cl |
InChI | InChI | 1.03 | InChI=1S/C15H12Cl4O2/c1-15(2,7-3-9(16)13(20)10(17)4-7)8-5-11(18)14(21)12(19)6-8/h3-6,20-21H,1-2H3 |
InChIKey | InChI | 1.03 | KYPYTERUKNKOLP-UHFFFAOYSA-N |