HIT ID: HIT106851671
Cas No: 63675-72-9
分子式: C20H24N2O6
分子量: 388.42
常用名: Nisoldipine
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 4.582000000000000e+000
IUPAC: 3-methyl 5-(2-methylpropyl) 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC: 3-methyl 5-(2-methylpropyl) 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SMILES: COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OCC(C)C |c:4,9|
SMILES: COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OCC(C)C |c:4,9|
InChI key: VKQFCGNPDRICFG-UHFFFAOYSA-N
