| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H13ClFN3O3/c17-10-5-4-8(6-11(10)18)9-7-13(9)20-16(22)15-12(19)2-1-3-14(15)21(23)24/h1-6,9,13H,7,19H2,(H,20,22)/t9-,13+/m0/s1 |
| InChIKey | InChI | 1.06 | SICLOXFVNCVVMM-TVQRCGJNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cccc(c1C(=O)N[C@@H]2C[C@H]2c3ccc(Cl)c(F)c3)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | Nc1cccc(c1C(=O)N[CH]2C[CH]2c3ccc(Cl)c(F)c3)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)[N+](=O)[O-])C(=O)N[C@@H]2C[C@H]2c3ccc(c(c3)F)Cl)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)[N+](=O)[O-])C(=O)NC2CC2c3ccc(c(c3)F)Cl)N |
