| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(O)C1CCCC1c1ccc2ncn(C)c2c1 |
| InChI | InChI | 1.06 | InChI=1S/C14H16N2O2/c1-16-8-15-12-6-5-9(7-13(12)16)10-3-2-4-11(10)14(17)18/h5-8,10-11H,2-4H2,1H3,(H,17,18)/t10-,11-/m1/s1 |
| InChIKey | InChI | 1.06 | JKQNZNKKFBLZGL-GHMZBOCLSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cnc2ccc(cc12)[C@H]3CCC[C@H]3C(O)=O |
| SMILES | CACTVS | 3.385 | Cn1cnc2ccc(cc12)[CH]3CCC[CH]3C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cn1cnc2c1cc(cc2)[C@H]3CCC[C@H]3C(=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cn1cnc2c1cc(cc2)C3CCCC3C(=O)O |
