| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(NS(=O)(=O)c1cccc2c1cccc2N(C)C)CCC |
| SMILES_CANONICAL | CACTVS | 3.352 | CCC[C@H](N[S](=O)(=O)c1cccc2c(cccc12)N(C)C)C(O)=O |
| SMILES | CACTVS | 3.352 | CCC[CH](N[S](=O)(=O)c1cccc2c(cccc12)N(C)C)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CCC[C@@H](C(=O)O)NS(=O)(=O)c1cccc2c1cccc2N(C)C |
| SMILES | OpenEye OEToolkits | 1.6.1 | CCCC(C(=O)O)NS(=O)(=O)c1cccc2c1cccc2N(C)C |
| InChI | InChI | 1.03 | InChI=1S/C17H22N2O4S/c1-4-7-14(17(20)21)18-24(22,23)16-11-6-8-12-13(16)9-5-10-15(12)19(2)3/h5-6,8-11,14,18H,4,7H2,1-3H3,(H,20,21)/t14-/m0/s1 |
| InChIKey | InChI | 1.03 | XRCZZVVWVGSUGJ-AWEZNQCLSA-N |
