| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H21NO4S/c1-12(2)8-9-21-14-10-13(6-7-17(14)26-11-18(21)24)20(25)19-15(22)4-3-5-16(19)23/h6-8,10,22H,3-5,9,11H2,1-2H3 |
| InChIKey | InChI | 1.06 | HUDLPHGXXZAIFM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)=CCN1C(=O)CSc2ccc(cc12)C(=O)C3=C(O)CCCC3=O |
| SMILES | CACTVS | 3.385 | CC(C)=CCN1C(=O)CSc2ccc(cc12)C(=O)C3=C(O)CCCC3=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=CCN1c2cc(ccc2SCC1=O)C(=O)C3=C(CCCC3=O)O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=CCN1c2cc(ccc2SCC1=O)C(=O)C3=C(CCCC3=O)O)C |
