| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C28H30N4O4/c33-24-9-8-23(25(34)29-24)32-17-20-6-7-21(16-22(20)27(32)36)31-15-12-28(18-31)10-13-30(14-11-28)26(35)19-4-2-1-3-5-19/h1-7,16,23H,8-15,17-18H2,(H,29,33,34)/t23-/m0/s1 |
| InChIKey | InChI | 1.06 | MMJAYQPOAOAOHR-QHCPKHFHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CC[C@H](N2Cc3ccc(cc3C2=O)N4CCC5(CCN(CC5)C(=O)c6ccccc6)C4)C(=O)N1 |
| SMILES | CACTVS | 3.385 | O=C1CC[CH](N2Cc3ccc(cc3C2=O)N4CCC5(CCN(CC5)C(=O)c6ccccc6)C4)C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(=O)N2CCC3(CC2)CCN(C3)c4ccc5c(c4)C(=O)N(C5)[C@H]6CCC(=O)NC6=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(=O)N2CCC3(CC2)CCN(C3)c4ccc5c(c4)C(=O)N(C5)C6CCC(=O)NC6=O |
