N-hexyl-4-methyl-N-[(E)-3,3,3-tris(fluoranyl)prop-1-enyl]benzenesulfonamide

Systemtic Name: N-hexyl-4-methyl-N-[(E)-3,3,3-tris(fluoranyl)prop-1-enyl]benzenesulfonamide Openeye Name: N-hexyl-4-methyl-N-[(E)-3,3,3-trifluoroprop-1-enyl]benzenesulfonamide CAS Name: N-hexyl-4-methyl-N-[(E)-3,3,3-trifluoroprop-1-enyl]benzenesulfonamide IUPAC Name: N-hexyl-4-methyl-N-[(E)-3,3,3-trifluoroprop-1-enyl]benzenesulfonamide Traditional Name: N-hexyl-4-methyl-N-[(E)-3,3,3-trifluoroprop-1-enyl]benzenesulfonamide Formula: C16H22F3NO2S MolecularWeight: 349.41159

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C=CC(F)(F)F)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCN(/C=C/C(F)(F)F)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H22F3NO2S/c1-3-4-5-6-12-20(13-11-16(17,18)19)23(21,22)15-9-7-14(2)8-10-15/h7-11,13H,3-6,12H2,1-2H3/b13-11+