1-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-(trifluoromethyl)-4-quinolin-1-iumyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazino]ethanone Formula: C16H17F3N3O+ MolecularWeight: 324.32089

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O/c1-11(23)21-6-8-22(9-7-21)14-10-15(16(17,18)19)20-13-5-3-2-4-12(13)14/h2-5,10H,6-9H2,1H3/p+1