| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Ic2ccc(\N=C1\C(=CC=C(F)C1F)C(=O)NOCCO)c(F)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | OCCONC(=O)C1=CC=C(F)[C@@H](F)C1=Nc2ccc(I)cc2F |
| SMILES | CACTVS | 3.341 | OCCONC(=O)C1=CC=C(F)[CH](F)C1=Nc2ccc(I)cc2F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1I)F)N=C2C(C(=CC=C2C(=O)NOCCO)F)F |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1I)F)N=C2C(C(=CC=C2C(=O)NOCCO)F)F |
| InChI | InChI | 1.03 | InChI=1S/C15H12F3IN2O3/c16-10-3-2-9(15(23)21-24-6-5-22)14(13(10)18)20-12-4-1-8(19)7-11(12)17/h1-4,7,13,22H,5-6H2,(H,21,23)/b20-14-/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | BDLJJGJCIWWATJ-OOHURIHSSA-N |
