N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-4-methoxy-2,3,6-trimethyl-benzenesulfonamide CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-methoxy-2,3,6-trimethylbenzenesulfonamide Traditional Name: N-(3-bromo-4-fluoro-benzyl)-4-methoxy-2,3,6-trimethyl-benzenesulfonamide Formula: C17H19BrFNO3S MolecularWeight: 416.305063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NCC2=CC(=C(C=C2)F)Br)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NCC2=CC(=C(C=C2)F)Br)C)C)OC

InChI

InChI=1S/C17H19BrFNO3S/c1-10-7-16(23-4)11(2)12(3)17(10)24(21,22)20-9-13-5-6-15(19)14(18)8-13/h5-8,20H,9H2,1-4H3