| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Clc1cccc(c1)C3(CCC(N2C(=O)CCCC2)CC3)CN |
| InChI | InChI | 1.03 | InChI=1S/C18H25ClN2O/c19-15-5-3-4-14(12-15)18(13-20)9-7-16(8-10-18)21-11-2-1-6-17(21)22/h3-5,12,16H,1-2,6-11,13,20H2/t16-,18- |
| InChIKey | InChI | 1.03 | HPAJLBAQCKXNNT-SAABIXHNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC[C@@]1(CC[C@@H](CC1)N2CCCCC2=O)c3cccc(Cl)c3 |
| SMILES | CACTVS | 3.385 | NC[C]1(CC[CH](CC1)N2CCCCC2=O)c3cccc(Cl)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)Cl)C2(CCC(CC2)N3CCCCC3=O)CN |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)Cl)C2(CCC(CC2)N3CCCCC3=O)CN |
