5-bromanyl-N-[[3-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-2-methoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[[3-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-2-methoxy-benzenesulfonamide Openeye Name: 5-bromo-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-methoxybenzenesulfonamide IUPAC Name: 5-bromo-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-methoxybenzenesulfonamide Traditional Name: 5-bromo-N-[3-fluoro-4-(trifluoromethyl)benzyl]-2-methoxy-benzenesulfonamide Formula: C15H12BrF4NO3S MolecularWeight: 442.223293

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCC2=CC(=C(C=C2)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCC2=CC(=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C15H12BrF4NO3S/c1-24-13-5-3-10(16)7-14(13)25(22,23)21-8-9-2-4-11(12(17)6-9)15(18,19)20/h2-7,21H,8H2,1H3