(4-chlorophenyl) 3-methyl-2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]butanoate

Systemtic Name: (4-chlorophenyl) 3-methyl-2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]butanoate Openeye Name: (4-chlorophenyl) 3-methyl-2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]butanoate CAS Name: 3-methyl-2-[[3-(trifluoromethylthio)phenyl]methyl]butanoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 3-methyl-2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]butanoate Traditional Name: 3-methyl-2-[3-(trifluoromethylthio)benzyl]butyric acid (4-chlorophenyl) ester Formula: C19H18ClF3O2S MolecularWeight: 402.85823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC(=CC=C1)SC(F)(F)F)C(=O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(CC1=CC(=CC=C1)SC(F)(F)F)C(=O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClF3O2S/c1-12(2)17(18(24)25-15-8-6-14(20)7-9-15)11-13-4-3-5-16(10-13)26-19(21,22)23/h3-10,12,17H,11H2,1-2H3