能提供下邻苯二甲酸二异癸酯(DIDP)的SMILES文件吗?
【已解决】
邻苯二甲酸二异癸酯(DIDP)的SMILES文件提供下,谢谢!!!
最佳答案
回答者:网友
O(C(C1=C([H])C([H])=C([H])C([H])=C1C(=O)OC([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H]