Chemical Compound

methyl (5R)-5-[4-cyano-2-[(4-hydroxy-1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-1,2,5,6,7,8a-hexahydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;formate

methyl (5R)-5-[4-cyano-2-[(4-hydroxy-1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-1,2,5,6,7,8a-hexahydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;formate 结构式
Primary record

methyl (5R)-5-[4-cyano-2-[(4-hydroxy-1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-1,2,5,6,7,8a-hexahydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;formate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
158515041
SMILES
CC1C([C@@H](N2C(N1C3=CC=CC(=C3)C(F)(F)F)NNC2=O)C4=C(C=C(C=C4)C#N)C[N+]5(CCC(CC5)O)C)C(=O)OC.C(=O)[O-]
Canonical SMILES
COC(=O)C1C(C)N(c2cccc(C(F)(F)F)c2)C2NNC(=O)N2[C@H]1c1ccc(C#N)cc1C[N+]1(C)CCC(O)CC1.O=C[O-]

名称与同义词

  • HLNHYODJRLPOPU-HWDKSOROSA-N
  • methyl (5R)-5-[4-cyano-2-[(4-hydroxy-1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-1,2,5,6,7,8a-hexahydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;formate