Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1ccc(cc1)c1ccc(F)cc1COc1ccc(cc1)CCC(=O)O |
InChI | InChI | 1.06 | InChI=1S/C23H21FO3/c1-16-2-7-18(8-3-16)22-12-9-20(24)14-19(22)15-27-21-10-4-17(5-11-21)6-13-23(25)26/h2-5,7-12,14H,6,13,15H2,1H3,(H,25,26) |
InChIKey | InChI | 1.06 | LPGBXHWIQNZEJB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(cc1)c2ccc(F)cc2COc3ccc(CCC(O)=O)cc3 |
SMILES | CACTVS | 3.385 | Cc1ccc(cc1)c2ccc(F)cc2COc3ccc(CCC(O)=O)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)c2ccc(cc2COc3ccc(cc3)CCC(=O)O)F |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)c2ccc(cc2COc3ccc(cc3)CCC(=O)O)F |