| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NOCC(O)CO)c1c(c(F)c(F)cc1)Nc2ccc(I)cc2F |
| SMILES_CANONICAL | CACTVS | 3.341 | OC[C@@H](O)CONC(=O)c1ccc(F)c(F)c1Nc2ccc(I)cc2F |
| SMILES | CACTVS | 3.341 | OC[CH](O)CONC(=O)c1ccc(F)c(F)c1Nc2ccc(I)cc2F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)NOC[C@@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)NOCC(CO)O |
| InChI | InChI | 1.03 | InChI=1S/C16H14F3IN2O4/c17-11-3-2-10(16(25)22-26-7-9(24)6-23)15(14(11)19)21-13-4-1-8(20)5-12(13)18/h1-5,9,21,23-24H,6-7H2,(H,22,25)/t9-/m1/s1 |
| InChIKey | InChI | 1.03 | SUDAHWBOROXANE-SECBINFHSA-N |
