Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C20H24N4O3/c1-15(25)17-4-6-18(7-5-17)23-9-11-24(12-10-23)20(26)22-14-16-3-8-19(27-2)21-13-16/h3-8,13H,9-12,14H2,1-2H3,(H,22,26) |
InChIKey | InChI | 1.03 | IWZIKMPFQUSSMX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CNC(=O)N2CCN(CC2)c3ccc(cc3)C(C)=O)cn1 |
SMILES | CACTVS | 3.385 | COc1ccc(CNC(=O)N2CCN(CC2)c3ccc(cc3)C(C)=O)cn1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)NCc3ccc(nc3)OC |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)NCc3ccc(nc3)OC |