| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1ccc(cc1)C(C(=O)O)C)c2sc(I)cc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](C(O)=O)c1ccc(cc1)C(=O)c2sc(I)cc2 |
| SMILES | CACTVS | 3.341 | C[CH](C(O)=O)c1ccc(cc1)C(=O)c2sc(I)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](c1ccc(cc1)C(=O)c2ccc(s2)I)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(c1ccc(cc1)C(=O)c2ccc(s2)I)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H11IO3S/c1-8(14(17)18)9-2-4-10(5-3-9)13(16)11-6-7-12(15)19-11/h2-8H,1H3,(H,17,18)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | UIZPHGUBGPJBAR-QMMMGPOBSA-N |
