Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Fc1ccc2c(c1)N(C(=O)OC(C)C)C(C(=O)N2)CC |
SMILES_CANONICAL | CACTVS | 3.341 | CC[C@@H]1N(C(=O)OC(C)C)c2cc(F)ccc2NC1=O |
SMILES | CACTVS | 3.341 | CC[CH]1N(C(=O)OC(C)C)c2cc(F)ccc2NC1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC[C@H]1C(=O)Nc2ccc(cc2N1C(=O)OC(C)C)F |
SMILES | OpenEye OEToolkits | 1.5.0 | CCC1C(=O)Nc2ccc(cc2N1C(=O)OC(C)C)F |
InChI | InChI | 1.03 | InChI=1S/C14H17FN2O3/c1-4-11-13(18)16-10-6-5-9(15)7-12(10)17(11)14(19)20-8(2)3/h5-8,11H,4H2,1-3H3,(H,16,18)/t11-/m0/s1 |
InChIKey | InChI | 1.03 | KELNNWMENBUHNS-NSHDSACASA-N |