| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NC(=O)C1CCCN(C1)C(=O)Cc1cc2OCOc2cc1Br |
| InChI | InChI | 1.06 | InChI=1S/C15H17BrN2O4/c16-11-6-13-12(21-8-22-13)4-10(11)5-14(19)18-3-1-2-9(7-18)15(17)20/h4,6,9H,1-3,5,7-8H2,(H2,17,20)/t9-/m0/s1 |
| InChIKey | InChI | 1.06 | ZWOYLBVAIIBBQA-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)[C@H]1CCCN(C1)C(=O)Cc2cc3OCOc3cc2Br |
| SMILES | CACTVS | 3.385 | NC(=O)[CH]1CCCN(C1)C(=O)Cc2cc3OCOc3cc2Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1c(c(cc2c1OCO2)Br)CC(=O)N3CCC[C@@H](C3)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1c(c(cc2c1OCO2)Br)CC(=O)N3CCCC(C3)C(=O)N |
