| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C1NC(C(=O)O)=C(C(=O)N1)CCCCc2ccc(C(=O)OC)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C17H18N2O6/c1-25-16(23)11-8-6-10(7-9-11)4-2-3-5-12-13(15(21)22)18-17(24)19-14(12)20/h6-9H,2-5H2,1H3,(H,21,22)(H2,18,19,20,24) |
| InChIKey | InChI | 1.03 | PWNZPCSVTUHWKU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | COC(=O)c1ccc(CCCCC2=C(NC(=O)NC2=O)C(O)=O)cc1 |
| SMILES | CACTVS | 3.370 | COC(=O)c1ccc(CCCCC2=C(NC(=O)NC2=O)C(O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | COC(=O)c1ccc(cc1)CCCCC2=C(NC(=O)NC2=O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | COC(=O)c1ccc(cc1)CCCCC2=C(NC(=O)NC2=O)C(=O)O |
