| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=C(N(CC(=O)O)CCNC)CN1C=C(C(=O)NC1=O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CNCCN(CC(O)=O)C(=O)CN1C=C(C)C(=O)NC1=O |
| SMILES | CACTVS | 3.341 | CNCCN(CC(O)=O)C(=O)CN1C=C(C)C(=O)NC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=CN(C(=O)NC1=O)CC(=O)N(CCNC)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=CN(C(=O)NC1=O)CC(=O)N(CCNC)CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H18N4O5/c1-8-5-16(12(21)14-11(8)20)6-9(17)15(4-3-13-2)7-10(18)19/h5,13H,3-4,6-7H2,1-2H3,(H,18,19)(H,14,20,21) |
| InChIKey | InChI | 1.03 | ZKSFEIQNOYBLHG-UHFFFAOYSA-N |
