Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | FC2CCN(C(=O)C(N)C(C)C1CCC(N(C(=O)C)C)CC1)C2 |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@H]([C@H](N)C(=O)N1CC[C@H](F)C1)[C@@H]2CC[C@H](CC2)N(C)C(C)=O |
SMILES | CACTVS | 3.341 | C[CH]([CH](N)C(=O)N1CC[CH](F)C1)[CH]2CC[CH](CC2)N(C)C(C)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](C1CCC(CC1)N(C)C(=O)C)[C@@H](C(=O)N2CC[C@@H](C2)F)N |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(C1CCC(CC1)N(C)C(=O)C)C(C(=O)N2CCC(C2)F)N |
InChI | InChI | 1.03 | InChI=1S/C17H30FN3O2/c1-11(16(19)17(23)21-9-8-14(18)10-21)13-4-6-15(7-5-13)20(3)12(2)22/h11,13-16H,4-10,19H2,1-3H3/t11-,13-,14-,15-,16-/m0/s1 |
InChIKey | InChI | 1.03 | BZFQBRSDORUYAB-YDMUCJKGSA-N |