Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc3ccc(/C(c1ccc(cc1)O)=C2/CCC(CC2)CF)cc3 |
InChI | InChI | 1.03 | InChI=1S/C20H21FO2/c21-13-14-1-3-15(4-2-14)20(16-5-9-18(22)10-6-16)17-7-11-19(23)12-8-17/h5-12,14,22-23H,1-4,13H2 |
InChIKey | InChI | 1.03 | RNELYPCZWXQACW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(cc1)[C](=[C]2CC[CH](CF)CC2)c3ccc(O)cc3 |
SMILES | CACTVS | 3.385 | Oc1ccc(cc1)[C](=[C]2CC[CH](CF)CC2)c3ccc(O)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1C(=C2CCC(CC2)CF)c3ccc(cc3)O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1C(=C2CCC(CC2)CF)c3ccc(cc3)O)O |