(4-{3-[3-Bromo-5-(3-piperidin-1-yl-prop-1-ynyl)-phenyl]-prop-2-ynyloxy}-2-methyl-phenoxy)-acetic acid methyl ester (HCID 67157959)

基本情報

標準SMILES: COC(=O)COc1ccc(OCC#Cc2cc(Br)cc(C#CCN3CCCCC3)c2)cc1C
InChIKey: QLSNIUFNCDNMFD-UHFFFAOYSA-N
分子式: C27H28BrNO4
平均分子量: 510.4 g/mol
単同位体質量: 509.12017

名称と識別子

優先名称: (4-{3-[3-Bromo-5-(3-piperidin-1-yl-prop-1-ynyl)-phenyl]-prop-2-ynyloxy}-2-methyl-phenoxy)-acetic acid methyl ester
IUPAC: methyl 2-[4-[3-[3-bromo-5-(3-piperidin-1-ylprop-1-ynyl)phenyl]prop-2-ynoxy]-2-methylphenoxy]acetate

名称と別名

SCHEMBL1777586QLSNIUFNCDNMFD-UHFFFAOYSA-N(4-{3-[3-bromo-5-(3-piperidin-1-yl-prop-1-ynyl)-phenyl]-prop-2-ynyloxy}-2-methyl-phenoxy)-acetic acid methyl ester