| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1nccc(c1)c3cc2cnccc2cc3)C4CC4 |
| InChI | InChI | 1.03 | InChI=1S/C18H15N3O/c22-18(13-2-3-13)21-17-10-15(6-8-20-17)14-4-1-12-5-7-19-11-16(12)9-14/h1,4-11,13H,2-3H2,(H,20,21,22) |
| InChIKey | InChI | 1.03 | PGKFRHOTYGEBDX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Nc1cc(ccn1)c2ccc3ccncc3c2)C4CC4 |
| SMILES | CACTVS | 3.385 | O=C(Nc1cc(ccn1)c2ccc3ccncc3c2)C4CC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc2c1ccnc2)c3ccnc(c3)NC(=O)C4CC4 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc2c1ccnc2)c3ccnc(c3)NC(=O)C4CC4 |
