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

Systemtic Name: (3S)-1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[[4-(trifluoromethyl)phenyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[4-(trifluoromethyl)benzyl]piperidin-1-ium-3-carboxamide Formula: C14H18F3N2O+ MolecularWeight: 287.30073

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)C(F)(F)F)C(=O)N

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)C(F)(F)F)C(=O)N

InChI

InChI=1S/C14H17F3N2O/c15-14(16,17)12-5-3-10(4-6-12)8-19-7-1-2-11(9-19)13(18)20/h3-6,11H,1-2,7-9H2,(H2,18,20)/p+1/t11-/m0/s1