| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1cccc2c1nc(C)cc2CO)C1CCNCC1 |
| InChI | InChI | 1.06 | InChI=1S/C17H21N3O2/c1-11-9-13(10-21)14-3-2-4-15(16(14)19-11)20-17(22)12-5-7-18-8-6-12/h2-4,9,12,18,21H,5-8,10H2,1H3,(H,20,22) |
| InChIKey | InChI | 1.06 | AGNLJARXPNPVNI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(CO)c2cccc(NC(=O)C3CCNCC3)c2n1 |
| SMILES | CACTVS | 3.385 | Cc1cc(CO)c2cccc(NC(=O)C3CCNCC3)c2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1cc(c2cccc(c2n1)NC(=O)C3CCNCC3)CO |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1cc(c2cccc(c2n1)NC(=O)C3CCNCC3)CO |
