Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc1cccc(Cl)c1C1Nc2ccccc2C(=O)N1 |
InChI | InChI | 1.06 | InChI=1S/C14H10ClFN2O/c15-9-5-3-6-10(16)12(9)13-17-11-7-2-1-4-8(11)14(19)18-13/h1-7,13,17H,(H,18,19)/t13-/m0/s1 |
InChIKey | InChI | 1.06 | DUZLGCVFNSELGL-ZDUSSCGKSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Fc1cccc(Cl)c1[C@@H]2NC(=O)c3ccccc3N2 |
SMILES | CACTVS | 3.385 | Fc1cccc(Cl)c1[CH]2NC(=O)c3ccccc3N2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)N[C@H](N2)c3c(cccc3Cl)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)NC(N2)c3c(cccc3Cl)F |