| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | OC(CNCC1CCCCC1)C(N)Cc2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C17H28N2O/c18-16(11-14-7-3-1-4-8-14)17(20)13-19-12-15-9-5-2-6-10-15/h1,3-4,7-8,15-17,19-20H,2,5-6,9-13,18H2/t16-,17+/m0/s1 |
| InChIKey | InChI | 1.03 | ZXSVBSSNAIRCGF-DLBZAZTESA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](Cc1ccccc1)[C@H](O)CNCC2CCCCC2 |
| SMILES | CACTVS | 3.370 | N[CH](Cc1ccccc1)[CH](O)CNCC2CCCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)C[C@@H]([C@@H](CNCC2CCCCC2)O)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)CC(C(CNCC2CCCCC2)O)N |
