Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C18H19FN2O2/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22/h1-8,16-17,21H,9-11H2,(H2,20,22)/t16-,17+/m1/s1 |
InChIKey | InChI | 1.06 | JESCETIFNOFKEU-SJORKVTESA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)[C@@H]1CC[C@@H](N1)c2ccc(OCc3ccccc3F)cc2 |
SMILES | CACTVS | 3.385 | NC(=O)[CH]1CC[CH](N1)c2ccc(OCc3ccccc3F)cc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)COc2ccc(cc2)[C@H]3CC[C@H](N3)C(=O)N)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)COc2ccc(cc2)C3CCC(N3)C(=O)N)F |