1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium

Systemtic Name: 1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium Openeye Name: 1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium CAS Name: 1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium IUPAC Name: 1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium Traditional Name: 1-ethyl-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium Formula: C13H18F3N2O2S+ MolecularWeight: 323.35443

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H17F3N2O2S/c1-2-17-7-9-18(10-8-17)21(19,20)12-6-4-3-5-11(12)13(14,15)16/h3-6H,2,7-10H2,1H3/p+1