| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.06 | InChI=1S/C19H20N2O/c22-19(21-12-15-8-4-5-9-16(15)13-21)18-10-17(11-20-18)14-6-2-1-3-7-14/h1-9,17-18,20H,10-13H2/p+1/t17-,18-/m1/s1 |
| InChIKey | InChI | 1.06 | CNNYTLGFUDHERQ-QZTJIDSGSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C([C@H]1C[C@H](C[NH2+]1)c2ccccc2)N3Cc4ccccc4C3 |
| SMILES | CACTVS | 3.385 | O=C([CH]1C[CH](C[NH2+]1)c2ccccc2)N3Cc4ccccc4C3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)[C@@H]2C[C@@H]([NH2+]C2)C(=O)N3Cc4ccccc4C3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C2CC([NH2+]C2)C(=O)N3Cc4ccccc4C3 |
