HIT ID: HIT212005486
Cas No: 230949-16-3
分子式: C22H32ClNO3
分子量: 393.95
常用名: Esoxybutynin Chloride
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 4.4380755
IUPAC: 4-(diethylamino)but-2-yn-1-yl (2S)-2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride
IUPAC: 4-(diethylamino)but-2-yn-1-yl (2S)-2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride
SMILES: Cl.CCN(CC)CC#CCOC(=O)[C@](O)(C1CCCCC1)c1ccccc1
SMILES: Cl.CCN(CC)CC#CCOC(=O)[C@](O)(C1CCCCC1)c1ccccc1
InChI key: SWIJYDAEGSIQPZ-VZYDHVRKSA-N
