| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(O)C(NCCC(N)Cc1ccccc1)Cc2ccccc2 |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@H](CCN[C@@H](Cc1ccccc1)C(O)=O)Cc2ccccc2 |
| SMILES | CACTVS | 3.370 | N[CH](CCN[CH](Cc1ccccc1)C(O)=O)Cc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)C[C@@H](CCN[C@@H](Cc2ccccc2)C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)CC(CCNC(Cc2ccccc2)C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C19H24N2O2/c20-17(13-15-7-3-1-4-8-15)11-12-21-18(19(22)23)14-16-9-5-2-6-10-16/h1-10,17-18,21H,11-14,20H2,(H,22,23)/t17-,18+/m1/s1 |
| InChIKey | InChI | 1.03 | SVTKCQQHQNLSOX-MSOLQXFVSA-N |
