| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | COc1cccc(C2Cc3occ(c3CC2)C(=O)O)c1Cl |
| InChI | InChI | 1.06 | InChI=1S/C16H15ClO4/c1-20-13-4-2-3-10(15(13)17)9-5-6-11-12(16(18)19)8-21-14(11)7-9/h2-4,8-9H,5-7H2,1H3,(H,18,19)/t9-/m0/s1 |
| InChIKey | InChI | 1.06 | HNIJGTIFZNMZJH-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc([C@H]2CCc3c(C2)occ3C(O)=O)c1Cl |
| SMILES | CACTVS | 3.385 | COc1cccc([CH]2CCc3c(C2)occ3C(O)=O)c1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1Cl)[C@H]2CCc3c(coc3C2)C(=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1Cl)C2CCc3c(coc3C2)C(=O)O |
