| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | CN1C(CC(C1)c2ccc(cc2)S(N3CCCCC3)(=O)=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C16H22N2O3S/c1-17-12-14(11-16(17)19)13-5-7-15(8-6-13)22(20,21)18-9-3-2-4-10-18/h5-8,14H,2-4,9-12H2,1H3/t14-/m0/s1 |
| InChIKey | InChI | 1.03 | FJZVEOQSYSYUQK-AWEZNQCLSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C[C@H](CC1=O)c2ccc(cc2)[S](=O)(=O)N3CCCCC3 |
| SMILES | CACTVS | 3.385 | CN1C[CH](CC1=O)c2ccc(cc2)[S](=O)(=O)N3CCCCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1C[C@H](CC1=O)c2ccc(cc2)S(=O)(=O)N3CCCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1CC(CC1=O)c2ccc(cc2)S(=O)(=O)N3CCCCC3 |
