N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-chloro-N-homopiperonyl-5-(trifluoromethyl)benzenesulfonamide Formula: C16H13ClF3NO4S MolecularWeight: 407.79193

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C16H13ClF3NO4S/c17-12-3-2-11(16(18,19)20)8-15(12)26(22,23)21-6-5-10-1-4-13-14(7-10)25-9-24-13/h1-4,7-8,21H,5-6,9H2