이름: intermediate 106
IUPAC: ethyl 2-[2-methyl-4-[2-methyl-1-[3-methyl-5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]-1-oxopropan-2-yl]phenoxy]acetate
SMILES:
CCOC(=O)COc1ccc(C(C)(C)C(=O)c2sc(-c3ccc(C(F)(F)F)cc3)cc2C)cc1CCanonical SMILES:
CCOC(=O)COC1=C(C=C(C=C1)C(C)(C)C(=O)C2=C(C=C(S2)C3=CC=C(C=C3)C(F)(F)F)C)C분자식: C27H27F3O4S
분자량: 504.60
InChIKey: CFLLWXXGUSMSOV-UHFFFAOYSA-N
InChI:
PubChem CID: 21986375 →InChI=1S/C27H27F3O4S/c1-6-33-23(31)15-34-21-12-11-20(13-16(21)2)26(4,5)25(32)24-17(3)14-22(35-24)18-7-9-19(10-8-18)27(28,29)30/h7-14H,6,15H2,1-5H3동의어
ethyl[4-(1,1-dimethyl-2{3-methyl-5-[4-(trifluoromethyl)phenyl]thien-2-yl}-2-oxoethyl)-2-methylphenoxy]acetateethyl[4-(1,1-dimethyl-2-{3-methyl-5-[4-(trifluoromethyl)phenyl]thien-2-yl}-2-oxoethyl)-2-methylphenoxy]acetate