1-[2-chloranyl-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexyl-methanesulfonamide

Systemtic Name: 1-[2-chloranyl-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexyl-methanesulfonamide Openeye Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexyl-methanesulfonamide CAS Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexylmethanesulfonamide IUPAC Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexylmethanesulfonamide Traditional Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-hexyl-methanesulfonamide Formula: C16H20ClF3N2O2S MolecularWeight: 396.85541

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClF3N2O2S/c1-2-3-4-5-9-22(10-8-21)25(23,24)12-13-6-7-14(11-15(13)17)16(18,19)20/h6-7,11H,2-5,9-10,12H2,1H3