| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C3NCC(Oc1nccc2c1cc(Br)cc2)C3 |
| InChI | InChI | 1.03 | InChI=1S/C14H13BrN2O3/c15-9-2-1-8-3-4-16-13(11(8)5-9)20-10-6-12(14(18)19)17-7-10/h1-5,10,12,17H,6-7H2,(H,18,19)/t10-,12+/m1/s1 |
| InChIKey | InChI | 1.03 | AXTJAJXOHLUNEA-PWSUYJOCSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)[C@@H]1C[C@H](CN1)Oc2nccc3ccc(Br)cc23 |
| SMILES | CACTVS | 3.370 | OC(=O)[CH]1C[CH](CN1)Oc2nccc3ccc(Br)cc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc2c1ccnc2O[C@@H]3C[C@H](NC3)C(=O)O)Br |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc2c1ccnc2OC3CC(NC3)C(=O)O)Br |
