| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C28H30N4O3/c1-35-26-12-11-21(22-9-5-6-10-23(22)26)18-31-14-13-25-24(19-31)27(30-32(25)15-16-33)28(34)29-17-20-7-3-2-4-8-20/h2-12,33H,13-19H2,1H3,(H,29,34) |
| InChIKey | InChI | 1.03 | ZHTGDAFDEHXYSS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CN2CCc3n(CCO)nc(C(=O)NCc4ccccc4)c3C2)c5ccccc15 |
| SMILES | CACTVS | 3.385 | COc1ccc(CN2CCc3n(CCO)nc(C(=O)NCc4ccccc4)c3C2)c5ccccc15 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | COc1ccc(c2c1cccc2)CN3CCc4c(c(nn4CCO)C(=O)NCc5ccccc5)C3 |
| SMILES | OpenEye OEToolkits | 2.0.5 | COc1ccc(c2c1cccc2)CN3CCc4c(c(nn4CCO)C(=O)NCc5ccccc5)C3 |
