N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide

Systemtic Name: N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide Openeye Name: N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide CAS Name: N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide IUPAC Name: N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide Traditional Name: N-(cyanomethyl)-N-hex-5-ynyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide Formula: C16H17F3N2O2S MolecularWeight: 358.37859

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCCN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

C#CCCCCN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O2S/c1-2-3-4-5-10-21(11-9-20)24(22,23)13-14-7-6-8-15(12-14)16(17,18)19/h1,6-8,12H,3-5,10-11,13H2