| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | c2c(c(NCc1ccco1)nc(C)c2)C(=O)N3CCCCCC3 |
| InChI | InChI | 1.03 | InChI=1S/C18H23N3O2/c1-14-8-9-16(18(22)21-10-4-2-3-5-11-21)17(20-14)19-13-15-7-6-12-23-15/h6-9,12H,2-5,10-11,13H2,1H3,(H,19,20) |
| InChIKey | InChI | 1.03 | JCTPWJNVLSRFOU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(C(=O)N2CCCCCC2)c(NCc3occc3)n1 |
| SMILES | CACTVS | 3.385 | Cc1ccc(C(=O)N2CCCCCC2)c(NCc3occc3)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cc1ccc(c(n1)NCc2ccco2)C(=O)N3CCCCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cc1ccc(c(n1)NCc2ccco2)C(=O)N3CCCCCC3 |
