| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(O)C(n1nccn1)Cc2ccc(cc2)CCCc3nc(oc3C)c4ccccc4 |
| SMILES_CANONICAL | CACTVS | 3.352 | Cc1oc(nc1CCCc2ccc(C[C@H](n3nccn3)C(O)=O)cc2)c4ccccc4 |
| SMILES | CACTVS | 3.352 | Cc1oc(nc1CCCc2ccc(C[CH](n3nccn3)C(O)=O)cc2)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1c(nc(o1)c2ccccc2)CCCc3ccc(cc3)C[C@@H](C(=O)O)n4nccn4 |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1c(nc(o1)c2ccccc2)CCCc3ccc(cc3)CC(C(=O)O)n4nccn4 |
| InChI | InChI | 1.03 | InChI=1S/C24H24N4O3/c1-17-21(27-23(31-17)20-7-3-2-4-8-20)9-5-6-18-10-12-19(13-11-18)16-22(24(29)30)28-25-14-15-26-28/h2-4,7-8,10-15,22H,5-6,9,16H2,1H3,(H,29,30)/t22-/m0/s1 |
| InChIKey | InChI | 1.03 | MBNINRCJDJMURD-QFIPXVFZSA-N |
