HIT ID: HIT212714403
Cas No: 82168-26-1
分子式: C20H26ClNO3
分子量: 363.88
常用名: Adafenoxate
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 3.7704997
IUPAC: 2-[(adamantan-1-yl)amino]ethyl 2-(4-chlorophenoxy)acetate
IUPAC: 2-[(adamantan-1-yl)amino]ethyl 2-(4-chlorophenoxy)acetate
SMILES: Clc1ccc(OCC(=O)OCCNC23CC4CC(CC(C4)C2)C3)cc1
SMILES: Clc1ccc(OCC(=O)OCCNC23CC4CC(CC(C4)C2)C3)cc1
InChI key: PLSMXIQMWYSHIV-UHFFFAOYSA-N