| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(NC(=O)C1CC=CC1)Cc1c[NH]cn1 |
| InChI | InChI | 1.03 | InChI=1S/C12H15N3O3/c16-11(8-3-1-2-4-8)15-10(12(17)18)5-9-6-13-7-14-9/h1-2,6-8,10H,3-5H2,(H,13,14)(H,15,16)(H,17,18)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | SKAVNIUEIPWYLP-JTQLQIEISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C2CC=CC2 |
| SMILES | CACTVS | 3.385 | OC(=O)[CH](Cc1c[nH]cn1)NC(=O)C2CC=CC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(nc[nH]1)C[C@@H](C(=O)O)NC(=O)C2CC=CC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(nc[nH]1)CC(C(=O)O)NC(=O)C2CC=CC2 |
