piperazin-4-ium-1-yl-[3-(trifluoromethyl)phenyl]methanone

Systemtic Name: piperazin-4-ium-1-yl-[3-(trifluoromethyl)phenyl]methanone Openeye Name: piperazin-4-ium-1-yl-[3-(trifluoromethyl)phenyl]methanone CAS Name: 1-piperazin-4-iumyl-[3-(trifluoromethyl)phenyl]methanone IUPAC Name: piperazin-4-ium-1-yl-[3-(trifluoromethyl)phenyl]methanone Traditional Name: piperazin-4-ium-1-yl-[3-(trifluoromethyl)phenyl]methanone Formula: C12H14F3N2O+ MolecularWeight: 259.24757

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C12H13F3N2O/c13-12(14,15)10-3-1-2-9(8-10)11(18)17-6-4-16-5-7-17/h1-3,8,16H,4-7H2/p+1