| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C22H23N3O6S/c26-14-19(15-4-2-1-3-5-15)22(27)24-10-16-12-25(13-17(16)11-24)32(28,29)18-8-20-21(23-9-18)31-7-6-30-20/h1-5,8-9,19,26H,6-7,10-14H2/t19-/m0/s1 |
| InChIKey | InChI | 1.06 | KZFFYEPYCVDOGE-IBGZPJMESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@H](C(=O)N1CC2=C(C1)CN(C2)[S](=O)(=O)c3cnc4OCCOc4c3)c5ccccc5 |
| SMILES | CACTVS | 3.385 | OC[CH](C(=O)N1CC2=C(C1)CN(C2)[S](=O)(=O)c3cnc4OCCOc4c3)c5ccccc5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)[C@H](CO)C(=O)N2CC3=C(C2)CN(C3)S(=O)(=O)c4cc5c(nc4)OCCO5 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(CO)C(=O)N2CC3=C(C2)CN(C3)S(=O)(=O)c4cc5c(nc4)OCCO5 |
