| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | COc1cccc(c1)C1Cc2occ(c2CC1)C(=O)O |
| InChI | InChI | 1.06 | InChI=1S/C16H16O4/c1-19-12-4-2-3-10(7-12)11-5-6-13-14(16(17)18)9-20-15(13)8-11/h2-4,7,9,11H,5-6,8H2,1H3,(H,17,18)/t11-/m0/s1 |
| InChIKey | InChI | 1.06 | PQSFNTDJGZIZDV-NSHDSACASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(c1)[C@H]2CCc3c(C2)occ3C(O)=O |
| SMILES | CACTVS | 3.385 | COc1cccc(c1)[CH]2CCc3c(C2)occ3C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1)[C@H]2CCc3c(coc3C2)C(=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1)C2CCc3c(coc3C2)C(=O)O |
