1-prop-2-ynyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium

Systemtic Name: 1-prop-2-ynyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-prop-2-ynyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-prop-2-ynyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-prop-2-ynyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-propargyl-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C14H16F3N2+ MolecularWeight: 269.28545

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH+]1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C#CC[NH+]1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H15F3N2/c1-2-6-18-7-9-19(10-8-18)13-5-3-4-12(11-13)14(15,16)17/h1,3-5,11H,6-10H2/p+1