1-(4-{1-Ethyl-1-[3-methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propyl}-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one (HCID 57708977)

基本情報

標準SMILES: CCC(CC)(c1ccc(OCC(=O)C(C)(C)C)c(C)c1)c1ccc(B2OC(C)(C)C(C)(C)O2)c(C)c1
InChIKey: WRSYMKJVOGYBMO-UHFFFAOYSA-N
分子式: C31H45BO4
平均分子量: 492.5 g/mol
単同位体質量: 492.3410901

名称と識別子

優先名称: 1-(4-{1-Ethyl-1-[3-methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propyl}-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one
IUPAC: 3,3-dimethyl-1-[2-methyl-4-[3-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pentan-3-yl]phenoxy]butan-2-one

名称と別名

SCHEMBL1524944WRSYMKJVOGYBMO-UHFFFAOYSA-N1-(4-{1-ethyl-1-[3-methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-propyl}-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one