| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1c(OCC(=O)O)cc(Cl)cc1)NCc2ccc(I)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C16H13ClINO4/c17-11-3-6-13(14(7-11)23-9-15(20)21)16(22)19-8-10-1-4-12(18)5-2-10/h1-7H,8-9H2,(H,19,22)(H,20,21) |
| InChIKey | InChI | 1.03 | UQSRSOSZBNAGEM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)COc1cc(Cl)ccc1C(=O)NCc2ccc(I)cc2 |
| SMILES | CACTVS | 3.370 | OC(=O)COc1cc(Cl)ccc1C(=O)NCc2ccc(I)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1CNC(=O)c2ccc(cc2OCC(=O)O)Cl)I |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1CNC(=O)c2ccc(cc2OCC(=O)O)Cl)I |
