MDL | MFCD08752609 |
---|---|
InChIKey | NQGXVXHYGRAABB-JTQLQIEISA-N |
Inchi | 1S/C13H24N2O4/c1-13(2,3)19-12(17)15-8-6-7-10(9-15)11(16)14(4)18-5/h10H,6-9H2,1-5H3/t10-/m0/s1 |
SMILES | O(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])C(N1C([H])([H])C([H])([H])C([H])([H])[C@]([H])(C(N(C([H])([H])[H])OC([H])([H])[H])=O)C1([H])[H])=O |
氢键供体数量 | 0 |
---|---|
氢键受体数量 | 4 |
可旋转化学键数量 | 4 |
重原子数量 | 19 |
复杂度 | 338 |
拓扑分子极性表面积 | 59.1 |
SMILES:CON(C)C(=O)[C@@H]1CN(CCC1)C(=O)OC(C)(C)C
ExSMILES:272.17372
InChI:
InChIKey:
IUPACName:
分子式:FormulaHtmlC13H24N2O4