1-propylsulfonyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-propylsulfonyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Openeye Name: 1-propylsulfonyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium CAS Name: 1-propylsulfonyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-propylsulfonyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-4-ium Traditional Name: 1-propylsulfonyl-4-[2-(trifluoromethyl)benzyl]piperazin-4-ium Formula: C15H22F3N2O2S+ MolecularWeight: 351.40759

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC[NH+](CC1)CC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCCS(=O)(=O)N1CC[NH+](CC1)CC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C15H21F3N2O2S/c1-2-11-23(21,22)20-9-7-19(8-10-20)12-13-5-3-4-6-14(13)15(16,17)18/h3-6H,2,7-12H2,1H3/p+1