| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N2(C(C)=O)CC(c1ccccc1)C(C2)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C13H15NO3/c1-9(15)14-7-11(12(8-14)13(16)17)10-5-3-2-4-6-10/h2-6,11-12H,7-8H2,1H3,(H,16,17)/t11-,12+/m0/s1 |
| InChIKey | InChI | 1.03 | UJHLINFGICYWPQ-NWDGAFQWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1C[C@H]([C@@H](C1)c2ccccc2)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)N1C[CH]([CH](C1)c2ccccc2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1C[C@H]([C@@H](C1)C(=O)O)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CC(C(C1)C(=O)O)c2ccccc2 |
