| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | OC(=O)C1(C(O)=O)C(C1Cc1cccc(OC)c1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C19H18O5/c1-24-14-9-5-6-12(10-14)11-15-16(13-7-3-2-4-8-13)19(15,17(20)21)18(22)23/h2-10,15-16H,11H2,1H3,(H,20,21)(H,22,23)/t15-,16+/m1/s1 |
| InChIKey | InChI | 1.06 | NSPQMAIUKTWPDQ-CVEARBPZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(C[C@@H]2[C@H](c3ccccc3)C2(C(O)=O)C(O)=O)c1 |
| SMILES | CACTVS | 3.385 | COc1cccc(C[CH]2[CH](c3ccccc3)C2(C(O)=O)C(O)=O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1)C[C@@H]2[C@@H](C2(C(=O)O)C(=O)O)c3ccccc3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1cccc(c1)CC2C(C2(C(=O)O)C(=O)O)c3ccccc3 |
