| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=S(=O)(c1ccccc1OC)N1CCCC(C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C13H18N2O4S/c1-19-11-6-2-3-7-12(11)20(17,18)15-8-4-5-10(9-15)13(14)16/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,14,16)/t10-/m0/s1 |
| InChIKey | InChI | 1.06 | QKOJMHTYLAMSOM-JTQLQIEISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1[S](=O)(=O)N2CCC[C@@H](C2)C(N)=O |
| SMILES | CACTVS | 3.385 | COc1ccccc1[S](=O)(=O)N2CCC[CH](C2)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1ccccc1S(=O)(=O)N2CCC[C@@H](C2)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1ccccc1S(=O)(=O)N2CCCC(C2)C(=O)N |
