HIT ID: HIT212686681
Cas No: 76093-35-1
分子式: C26H29N3O6
分子量: 479.533
常用名: (R)-Nicardipine
氢键受体数 (HBA): 6
氢键供体数 (HBD): 1
LogP: 3.5586119
IUPAC: 3-{2-[benzyl(methyl)amino]ethyl} 5-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC: 3-{2-[benzyl(methyl)amino]ethyl} 5-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SMILES: COC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc(c1)[N+]([O-])=O)C(=O)OCCN(C)Cc1ccccc1 |c:4,9|
SMILES: COC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc(c1)[N+]([O-])=O)C(=O)OCCN(C)Cc1ccccc1 |c:4,9|
InChI key: ZBBHBTPTTSWHBA-XMMPIXPASA-N
