2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]-N-hexyl-propanamide

Systemtic Name: 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]-N-hexyl-propanamide Openeye Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-phenoxy]-N-hexyl-propanamide CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)phenoxy]-N-hexylpropanamide IUPAC Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanylphenoxy]-N-hexylpropanamide Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)phenoxy]-N-hexyl-propionamide Formula: C23H27ClF3NO3S MolecularWeight: 489.97859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(C)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

Isomeric SMILES

CCCCCCNC(=O)C(C)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

InChI

InChI=1S/C23H27ClF3NO3S/c1-4-5-6-7-12-28-22(29)15(2)30-20-14-17(9-11-21(20)32-3)31-19-10-8-16(13-18(19)24)23(25,26)27/h8-11,13-15H,4-7,12H2,1-3H3,(H,28,29)