Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1cccc(c1F)CN3C(=O)c2ccc(O)c(O)c2C3=O |
InChI | InChI | 1.03 | InChI=1S/C15H9ClFNO4/c16-9-3-1-2-7(12(9)17)6-18-14(21)8-4-5-10(19)13(20)11(8)15(18)22/h1-5,19-20H,6H2 |
InChIKey | InChI | 1.03 | WMFOJSRDGWZYSC-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc2C(=O)N(Cc3cccc(Cl)c3F)C(=O)c2c1O |
SMILES | CACTVS | 3.370 | Oc1ccc2C(=O)N(Cc3cccc(Cl)c3F)C(=O)c2c1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)Cl)F)CN2C(=O)c3ccc(c(c3C2=O)O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)Cl)F)CN2C(=O)c3ccc(c(c3C2=O)O)O |