3-chloranyl-N-[[2-fluoranyl-3-(trifluoromethyl)phenyl]methyl]-4-methyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[[2-fluoranyl-3-(trifluoromethyl)phenyl]methyl]-4-methyl-benzenesulfonamide Openeye Name: 3-chloro-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]-4-methyl-benzenesulfonamide CAS Name: 3-chloro-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]-4-methylbenzenesulfonamide IUPAC Name: 3-chloro-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]-4-methylbenzenesulfonamide Traditional Name: 3-chloro-N-[2-fluoro-3-(trifluoromethyl)benzyl]-4-methyl-benzenesulfonamide Formula: C15H12ClF4NO2S MolecularWeight: 381.772893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=C(C(=CC=C2)C(F)(F)F)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=C(C(=CC=C2)C(F)(F)F)F)Cl

InChI

InChI=1S/C15H12ClF4NO2S/c1-9-5-6-11(7-13(9)16)24(22,23)21-8-10-3-2-4-12(14(10)17)15(18,19)20/h2-7,21H,8H2,1H3