| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c2c(OCCC[NH3+])cc(c1cnnc1)cc2)Nc3ccccc3 |
| InChI | InChI | 1.03 | InChI=1S/C19H20N4O2/c20-9-4-10-25-18-11-14(15-12-21-22-13-15)7-8-17(18)19(24)23-16-5-2-1-3-6-16/h1-3,5-8,11-13H,4,9-10,20H2,(H,21,22)(H,23,24)/p+1 |
| InChIKey | InChI | 1.03 | KLMWPYHIMXLJIE-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | [NH3+]CCCOc1cc(ccc1C(=O)Nc2ccccc2)c3c[nH]nc3 |
| SMILES | CACTVS | 3.385 | [NH3+]CCCOc1cc(ccc1C(=O)Nc2ccccc2)c3c[nH]nc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)NC(=O)c2ccc(cc2OCCC[NH3+])c3c[nH]nc3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)NC(=O)c2ccc(cc2OCCC[NH3+])c3c[nH]nc3 |
