Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc3ccc(c2nc(O)c(O)cc2c1ccc(F)cc1)cc3 |
InChI | InChI | 1.03 | InChI=1S/C17H11F2NO2/c18-12-5-1-10(2-6-12)14-9-15(21)17(22)20-16(14)11-3-7-13(19)8-4-11/h1-9,21H,(H,20,22) |
InChIKey | InChI | 1.03 | CIZBXDSIEHHRKM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc(c2ccc(F)cc2)c(nc1O)c3ccc(F)cc3 |
SMILES | CACTVS | 3.385 | Oc1cc(c2ccc(F)cc2)c(nc1O)c3ccc(F)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2cc(c(nc2c3ccc(cc3)F)O)O)F |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2cc(c(nc2c3ccc(cc3)F)O)O)F |