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

Systemtic Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(trifluoromethyl)benzyl]piperidin-1-ium-4-carboxylate Formula: C14H16F3NO2 MolecularWeight: 287.27755

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)[O-])CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H16F3NO2/c15-14(16,17)12-3-1-2-10(8-12)9-18-6-4-11(5-7-18)13(19)20/h1-3,8,11H,4-7,9H2,(H,19,20)