| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | C1CN(CCN1C(=O)C2CCCCCC2)S(=O)(=O)c4c3ccncc3ccc4 |
| InChI | InChI | 1.03 | InChI=1S/C21H27N3O3S/c25-21(17-6-3-1-2-4-7-17)23-12-14-24(15-13-23)28(26,27)20-9-5-8-18-16-22-11-10-19(18)20/h5,8-11,16-17H,1-4,6-7,12-15H2 |
| InChIKey | InChI | 1.03 | BNXUOKAWQPMNQC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(C1CCCCCC1)N2CCN(CC2)[S](=O)(=O)c3cccc4cnccc34 |
| SMILES | CACTVS | 3.385 | O=C(C1CCCCCC1)N2CCN(CC2)[S](=O)(=O)c3cccc4cnccc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2cnccc2c(c1)S(=O)(=O)N3CCN(CC3)C(=O)C4CCCCCC4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2cnccc2c(c1)S(=O)(=O)N3CCN(CC3)C(=O)C4CCCCCC4 |
