| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | O\N=C1\C(Nc2ccc(cc12)C(O)=O)=C3\C(=O)Nc4c(Br)cccc34 |
| SMILES | CACTVS | 3.352 | ON=C1C(Nc2ccc(cc12)C(O)=O)=C3C(=O)Nc4c(Br)cccc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc\2c(c(c1)Br)NC(=O)/C2=C\3/C(=N/O)/c4cc(ccc4N3)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc2c(c(c1)Br)NC(=O)C2=C3C(=NO)c4cc(ccc4N3)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C17H10BrN3O4/c18-10-3-1-2-8-12(16(22)20-13(8)10)15-14(21-25)9-6-7(17(23)24)4-5-11(9)19-15/h1-6,19,25H,(H,20,22)(H,23,24)/b15-12-,21-14+ |
| InChIKey | InChI | 1.03 | UHBJSHHMZNYBAE-HQMCVCOQSA-N |
