| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | Brc1cc(F)c(cc1)CNC(=O)c2ccc(Cl)cc2OCC(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)COc1cc(Cl)ccc1C(=O)NCc2ccc(Br)cc2F |
| SMILES | CACTVS | 3.341 | OC(=O)COc1cc(Cl)ccc1C(=O)NCc2ccc(Br)cc2F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1Cl)OCC(=O)O)C(=O)NCc2ccc(cc2F)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1Cl)OCC(=O)O)C(=O)NCc2ccc(cc2F)Br |
| InChI | InChI | 1.03 | InChI=1S/C16H12BrClFNO4/c17-10-2-1-9(13(19)5-10)7-20-16(23)12-4-3-11(18)6-14(12)24-8-15(21)22/h1-6H,7-8H2,(H,20,23)(H,21,22) |
| InChIKey | InChI | 1.03 | ZLIGBZRXAQNUFO-UHFFFAOYSA-N |
