N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-bromanyl-2-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-bromanyl-2-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-bromo-2-(trifluoromethoxy)benzenesulfonamide Traditional Name: 4-bromo-N-homopiperonyl-2-(trifluoromethoxy)benzenesulfonamide Formula: C16H13BrF3NO5S MolecularWeight: 468.24233

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNS(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNS(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C16H13BrF3NO5S/c17-11-2-4-15(14(8-11)26-16(18,19)20)27(22,23)21-6-5-10-1-3-12-13(7-10)25-9-24-12/h1-4,7-8,21H,5-6,9H2