| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Oc1cc(I)c(cc1OC)CNC(=O)CCCCCCC(C)C |
| InChI | InChI | 1.06 | InChI=1S/C18H28INO3/c1-13(2)8-6-4-5-7-9-18(22)20-12-14-10-17(23-3)16(21)11-15(14)19/h10-11,13,21H,4-9,12H2,1-3H3,(H,20,22) |
| InChIKey | InChI | 1.06 | WPVUDCLXIKWQHK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(CNC(=O)CCCCCCC(C)C)c(I)cc1O |
| SMILES | CACTVS | 3.385 | COc1cc(CNC(=O)CCCCCCC(C)C)c(I)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(C)CCCCCCC(=O)NCc1cc(c(cc1I)O)OC |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C)CCCCCCC(=O)NCc1cc(c(cc1I)O)OC |
