1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-one

Systemtic Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-one Openeye Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-one CAS Name: 1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidin-1-iumone IUPAC Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-one Traditional Name: 1-[3-(trifluoromethyl)benzyl]piperidin-1-ium-4-one Formula: C13H15F3NO+ MolecularWeight: 258.25951

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=O)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1C[NH+](CCC1=O)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C13H14F3NO/c14-13(15,16)11-3-1-2-10(8-11)9-17-6-4-12(18)5-7-17/h1-3,8H,4-7,9H2/p+1