| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=S(=O)(N(C(C(=O)NO)C(C)C)CC(C)C)c1cc(ccc1)COC |
| InChI | InChI | 1.03 | InChI=1S/C17H28N2O5S/c1-12(2)10-19(16(13(3)4)17(20)18-21)25(22,23)15-8-6-7-14(9-15)11-24-5/h6-9,12-13,16,21H,10-11H2,1-5H3,(H,18,20)/t16-/m1/s1 |
| InChIKey | InChI | 1.03 | FSBJQCWNYNVFOV-MRXNPFEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCc1cccc(c1)[S](=O)(=O)N(CC(C)C)[C@H](C(C)C)C(=O)NO |
| SMILES | CACTVS | 3.385 | COCc1cccc(c1)[S](=O)(=O)N(CC(C)C)[CH](C(C)C)C(=O)NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(C)CN([C@H](C(C)C)C(=O)NO)S(=O)(=O)c1cccc(c1)COC |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(C)CN(C(C(C)C)C(=O)NO)S(=O)(=O)c1cccc(c1)COC |
