N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-butyl-N-(cyanomethyl)-4-(trifluoromethyl)benzenesulfonamide Formula: C13H15F3N2O2S MolecularWeight: 320.33061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC#N)S(=O)(=O)C1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCCCN(CC#N)S(=O)(=O)C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C13H15F3N2O2S/c1-2-3-9-18(10-8-17)21(19,20)12-6-4-11(5-7-12)13(14,15)16/h4-7H,2-3,9-10H2,1H3