ethyl 4-(2,2-dimethyl-4-trifluoromethanesulfonyloxy-(2H)-thio-chromen-6-ylethynyl)-benzoate (HCID 10051511)

基本情報

標準SMILES: CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(OS(=O)(=O)C(F)(F)F)=CC(C)(C)S3)cc1
InChIKey: XSLHKWWBNMHWGA-UHFFFAOYSA-N
分子式: C23H19F3O5S2
平均分子量: 496.5 g/mol
単同位体質量: 496.06260054

名称と識別子

優先名称: ethyl 4-(2,2-dimethyl-4-trifluoromethanesulfonyloxy-(2H)-thio-chromen-6-ylethynyl)-benzoate
IUPAC: ethyl 4-[2-[2,2-dimethyl-4-(trifluoromethylsulfonyloxy)thiochromen-6-yl]ethynyl]benzoate

名称と別名

ethyl 4-(2,2-dimethyl-4-trifluoromethanesulfonyloxy-(2H)-thio-chromen-6-ylethynyl)-benzoateSCHEMBL1140980SCHEMBL38679865ethyl 4-(2,2-dimethyl-4-trifluoromethanesulfonyloxy-(2H)-thiochromen-6-ylethynyl)-benzoate