| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=C(O)CCc1c(cnc1/C=C3/c2ccccc2NC3=O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1CCC(O)=O |
| SMILES | CACTVS | 3.341 | Cc1c[nH]c(C=C2C(=O)Nc3ccccc23)c1CCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c[nH]c(c1CCC(=O)O)\C=C/2\c3ccccc3NC2=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c[nH]c(c1CCC(=O)O)C=C2c3ccccc3NC2=O |
| InChI | InChI | 1.03 | InChI=1S/C17H16N2O3/c1-10-9-18-15(11(10)6-7-16(20)21)8-13-12-4-2-3-5-14(12)19-17(13)22/h2-5,8-9,18H,6-7H2,1H3,(H,19,22)(H,20,21)/b13-8- |
| InChIKey | InChI | 1.03 | JNDVEAXZWJIOKB-JYRVWZFOSA-N |
