| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OCC)c3ccc(OCCCCC2CCN(c1nnc(cc1)C)CC2)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | CCOC(=O)c1ccc(OCCCCC2CCN(CC2)c3ccc(C)nn3)cc1 |
| SMILES | CACTVS | 3.341 | CCOC(=O)c1ccc(OCCCCC2CCN(CC2)c3ccc(C)nn3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCOC(=O)c1ccc(cc1)OCCCCC2CCN(CC2)c3ccc(nn3)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOC(=O)c1ccc(cc1)OCCCCC2CCN(CC2)c3ccc(nn3)C |
| InChI | InChI | 1.03 | InChI=1S/C23H31N3O3/c1-3-28-23(27)20-8-10-21(11-9-20)29-17-5-4-6-19-13-15-26(16-14-19)22-12-7-18(2)24-25-22/h7-12,19H,3-6,13-17H2,1-2H3 |
| InChIKey | InChI | 1.03 | AQILFLLHLFBLLG-UHFFFAOYSA-N |
