N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-bromanyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-bromanyl-2-methoxy-benzenesulfonamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-bromo-2-methoxy-benzenesulfonamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-bromo-2-methoxybenzenesulfonamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-bromo-2-methoxybenzenesulfonamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-5-bromo-2-methoxy-benzenesulfonamide Formula: C16H12BrF6NO3S MolecularWeight: 492.230799

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrF6NO3S/c1-27-13-3-2-12(17)7-14(13)28(25,26)24-8-9-4-10(15(18,19)20)6-11(5-9)16(21,22)23/h2-7,24H,8H2,1H3