| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(O)C(NC(=O)CCc1ccccc1)Cc3nc2ccccc2n3 |
| SMILES_CANONICAL | CACTVS | 3.352 | OC(=O)[C@@H](Cc1[nH]c2ccccc2n1)NC(=O)CCc3ccccc3 |
| SMILES | CACTVS | 3.352 | OC(=O)[CH](Cc1[nH]c2ccccc2n1)NC(=O)CCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CCC(=O)N[C@H](Cc2[nH]c3ccccc3n2)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CCC(=O)NC(Cc2[nH]c3ccccc3n2)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C19H19N3O3/c23-18(11-10-13-6-2-1-3-7-13)22-16(19(24)25)12-17-20-14-8-4-5-9-15(14)21-17/h1-9,16H,10-12H2,(H,20,21)(H,22,23)(H,24,25)/t16-/m1/s1 |
| InChIKey | InChI | 1.03 | AZXJPZVGZBWZMA-MRXNPFEDSA-N |
