Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O[Sn](O)(O)OCCNC1OC(C(O)C(O)C1N)CO |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@H]1NCCO[Sn](O)(O)O |
SMILES | CACTVS | 3.341 | N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1NCCO[Sn](O)(O)O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CO[Sn](O)(O)O)N[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CO[Sn](O)(O)O)NC1C(C(C(C(O1)CO)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C8H17N2O5.3H2O.Sn/c9-5-7(14)6(13)4(3-12)15-8(5)10-1-2-11;;;;/h4-8,10,12-14H,1-3,9H2;3*1H2;/q-1;;;;+4/p-3/t4-,5-,6+,7+,8+;;;;/m0..../s1 |
InChIKey | InChI | 1.03 | MAPJSMXDKVHPKF-JEQMFHPXSA-K |