Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1c(ccc(c1)O)Oc3sc2c(ccc(c2)O)c3c4ccc(cc4)F |
InChI | InChI | 1.03 | InChI=1S/C20H13FO3S/c21-13-3-1-12(2-4-13)19-17-10-7-15(23)11-18(17)25-20(19)24-16-8-5-14(22)6-9-16/h1-11,22-23H |
InChIKey | InChI | 1.03 | UDBMVVLTKJMPCJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(Oc2sc3cc(O)ccc3c2c4ccc(F)cc4)cc1 |
SMILES | CACTVS | 3.385 | Oc1ccc(Oc2sc3cc(O)ccc3c2c4ccc(F)cc4)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1c2c3ccc(cc3sc2Oc4ccc(cc4)O)O)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1c2c3ccc(cc3sc2Oc4ccc(cc4)O)O)F |