| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(O)c1[NH]c2ccccc2c1CNC(=O)c1ccc2[NH]cnc2c1 |
| InChI | InChI | 1.06 | InChI=1S/C18H14N4O3/c23-17(10-5-6-14-15(7-10)21-9-20-14)19-8-12-11-3-1-2-4-13(11)22-16(12)18(24)25/h1-7,9,22H,8H2,(H,19,23)(H,20,21)(H,24,25) |
| InChIKey | InChI | 1.06 | ZBKHDPZXZUDEDP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1[nH]c2ccccc2c1CNC(=O)c3ccc4[nH]cnc4c3 |
| SMILES | CACTVS | 3.385 | OC(=O)c1[nH]c2ccccc2c1CNC(=O)c3ccc4[nH]cnc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c([nH]2)C(=O)O)CNC(=O)c3ccc4c(c3)nc[nH]4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c([nH]2)C(=O)O)CNC(=O)c3ccc4c(c3)nc[nH]4 |
