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

Systemtic Name: cyclohexyl-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]methanone Openeye Name: cyclohexyl-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]methanone CAS Name: cyclohexyl-[4-[2-(trifluoromethyl)-4-quinolin-1-iumyl]-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazin-1-yl]methanone Traditional Name: cyclohexyl-[4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazino]methanone Formula: C21H25F3N3O+ MolecularWeight: 392.43791

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCN(CC2)C3=CC(=[NH+]C4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCN(CC2)C3=CC(=[NH+]C4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C21H24F3N3O/c22-21(23,24)19-14-18(16-8-4-5-9-17(16)25-19)26-10-12-27(13-11-26)20(28)15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2/p+1