Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C(C2(Cc1ccc(cc1)F)C(=O)N(CCOC)C(N2)=O)CO |
InChI | InChI | 1.03 | InChI=1S/C15H19FN2O4/c1-22-9-7-18-13(20)15(6-8-19,17-14(18)21)10-11-2-4-12(16)5-3-11/h2-5,19H,6-10H2,1H3,(H,17,21)/t15-/m0/s1 |
InChIKey | InChI | 1.03 | LEFBUGONDDVZFX-HNNXBMFYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COCCN1C(=O)N[C@@](CCO)(Cc2ccc(F)cc2)C1=O |
SMILES | CACTVS | 3.385 | COCCN1C(=O)N[C](CCO)(Cc2ccc(F)cc2)C1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COCCN1C(=O)[C@](NC1=O)(CCO)Cc2ccc(cc2)F |
SMILES | OpenEye OEToolkits | 2.0.6 | COCCN1C(=O)C(NC1=O)(CCO)Cc2ccc(cc2)F |