Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1NC(CCc2ccc(cc2)C(F)(F)F)=CNC1=O |
InChI | InChI | 1.03 | InChI=1S/C13H11F3N2O2/c14-13(15,16)9-4-1-8(2-5-9)3-6-10-7-17-11(19)12(20)18-10/h1-2,4-5,7H,3,6H2,(H,17,19)(H,18,20) |
InChIKey | InChI | 1.03 | YIASGIMSIFVHQL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)c1ccc(CCC2=CNC(=O)C(=O)N2)cc1 |
SMILES | CACTVS | 3.385 | FC(F)(F)c1ccc(CCC2=CNC(=O)C(=O)N2)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1CCC2=CNC(=O)C(=O)N2)C(F)(F)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1CCC2=CNC(=O)C(=O)N2)C(F)(F)F |