Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N2(C(=O)Nc1ccc(OC)cc1F)CCN(CC2)C(c3occc3)=O |
InChI | InChI | 1.03 | InChI=1S/C17H18FN3O4/c1-24-12-4-5-14(13(18)11-12)19-17(23)21-8-6-20(7-9-21)16(22)15-3-2-10-25-15/h2-5,10-11H,6-9H2,1H3,(H,19,23) |
InChIKey | InChI | 1.03 | FEVZYVVNRULDBL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(NC(=O)N2CCN(CC2)C(=O)c3occc3)c(F)c1 |
SMILES | CACTVS | 3.385 | COc1ccc(NC(=O)N2CCN(CC2)C(=O)c3occc3)c(F)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(c(c1)F)NC(=O)N2CCN(CC2)C(=O)c3ccco3 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(c(c1)F)NC(=O)N2CCN(CC2)C(=O)c3ccco3 |