2-bromanyl-5-(dimethylaminomethyl)-4-[4-(trifluoromethyloxy)phenoxy]benzenesulfonamide

Systemtic Name: 2-bromanyl-5-(dimethylaminomethyl)-4-[4-(trifluoromethyloxy)phenoxy]benzenesulfonamide Openeye Name: 2-bromo-5-(dimethylaminomethyl)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide CAS Name: 2-bromo-5-(dimethylaminomethyl)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide IUPAC Name: 2-bromo-5-(dimethylaminomethyl)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Traditional Name: 2-bromo-5-(dimethylaminomethyl)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Formula: C16H16BrF3N2O4S MolecularWeight: 469.27345

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)Br)S(=O)(=O)N

Isomeric SMILES

CN(C)CC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)Br)S(=O)(=O)N

InChI

InChI=1S/C16H16BrF3N2O4S/c1-22(2)9-10-7-15(27(21,23)24)13(17)8-14(10)25-11-3-5-12(6-4-11)26-16(18,19)20/h3-8H,9H2,1-2H3,(H2,21,23,24)