1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Formula: C13H17ClF3N2O2S+ MolecularWeight: 357.79949

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClF3N2O2S/c1-2-18-5-7-19(8-6-18)22(20,21)10-3-4-12(14)11(9-10)13(15,16)17/h3-4,9H,2,5-8H2,1H3/p+1