| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(c3ccccc3c(c1)N2CC(CC2)C(O)=O)NS(c4c(C)c(C)cc(c4C)C)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C25H28N2O4S/c1-15-13-16(2)18(4)24(17(15)3)32(30,31)26-22-9-10-23(21-8-6-5-7-20(21)22)27-12-11-19(14-27)25(28)29/h5-10,13,19,26H,11-12,14H2,1-4H3,(H,28,29)/t19-/m0/s1 |
| InChIKey | InChI | 1.03 | BVYWIQHJXAEJOD-IBGZPJMESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(C)c(C)c(c1C)[S](=O)(=O)Nc2ccc(N3CC[C@@H](C3)C(O)=O)c4ccccc24 |
| SMILES | CACTVS | 3.385 | Cc1cc(C)c(C)c(c1C)[S](=O)(=O)Nc2ccc(N3CC[CH](C3)C(O)=O)c4ccccc24 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc(c(c(c1C)S(=O)(=O)Nc2ccc(c3c2cccc3)N4CC[C@@H](C4)C(=O)O)C)C |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc(c(c(c1C)S(=O)(=O)Nc2ccc(c3c2cccc3)N4CCC(C4)C(=O)O)C)C |
