| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(c(ccc1S(=O)(=O)F)C)C(NCC(C(=O)O)NC(=O)C)=O |
| InChI | InChI | 1.03 | InChI=1S/C13H15FN2O6S/c1-7-3-4-9(23(14,21)22)5-10(7)12(18)15-6-11(13(19)20)16-8(2)17/h3-5,11H,6H2,1-2H3,(H,15,18)(H,16,17)(H,19,20)/t11-/m0/s1 |
| InChIKey | InChI | 1.03 | IIRSGDNKTQCYKZ-NSHDSACASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N[C@@H](CNC(=O)c1cc(ccc1C)[S](F)(=O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)N[CH](CNC(=O)c1cc(ccc1C)[S](F)(=O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1C(=O)NC[C@@H](C(=O)O)NC(=O)C)S(=O)(=O)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1C(=O)NCC(C(=O)O)NC(=O)C)S(=O)(=O)F |
