| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CC(C(=O)O)NC(=O)Cc2c1ccccc1nc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)C[C@H](NC(=O)Cc1c[nH]c2ccccc12)C(O)=O |
| SMILES | CACTVS | 3.341 | OC(=O)C[CH](NC(=O)Cc1c[nH]c2ccccc12)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)CC(=O)N[C@@H](CC(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)CC(=O)NC(CC(=O)O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H14N2O5/c17-12(16-11(14(20)21)6-13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)/t11-/m0/s1 |
| InChIKey | InChI | 1.03 | VAFNMNRKDDAKRM-NSHDSACASA-N |
