Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc1ccc(cc1)\C(=N/c2ccc(F)cc2)c3c(cc(cc3)O)O |
InChI | InChI | 1.03 | InChI=1S/C19H14FNO3/c20-13-3-5-14(6-4-13)21-19(12-1-7-15(22)8-2-12)17-10-9-16(23)11-18(17)24/h1-11,22-24H/b21-19+ |
InChIKey | InChI | 1.03 | KZWDEXMYVJJSFV-XUTLUUPISA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(cc1)C(=Nc2ccc(F)cc2)c3ccc(O)cc3O |
SMILES | CACTVS | 3.385 | Oc1ccc(cc1)C(=Nc2ccc(F)cc2)c3ccc(O)cc3O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1/C(=N\c2ccc(cc2)F)/c3ccc(cc3O)O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1C(=Nc2ccc(cc2)F)c3ccc(cc3O)O)O |