Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C24H28FN3O/c1-26-14-15-28-21-11-13-27(16-20(21)19-4-2-5-22(26)24(19)28)12-3-6-23(29)17-7-9-18(25)10-8-17/h2,4-5,7-10,20-21H,3,6,11-16H2,1H3/t20-,21-/m0/s1 |
InChIKey | InChI | 1.06 | HOIIHACBCFLJET-SFTDATJTSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1CCN2[C@H]3CCN(CCCC(=O)c4ccc(F)cc4)C[C@H]3c5cccc1c25 |
SMILES | CACTVS | 3.385 | CN1CCN2[CH]3CCN(CCCC(=O)c4ccc(F)cc4)C[CH]3c5cccc1c25 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCN2c3c1cccc3[C@H]4[C@@H]2CCN(C4)CCCC(=O)c5ccc(cc5)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCN2c3c1cccc3C4C2CCN(C4)CCCC(=O)c5ccc(cc5)F |