(3R)-N,N-diethyl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-N,N-diethyl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-N,N-diethyl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-N,N-diethyl-1-[[3-(trifluoromethyl)phenyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-N,N-diethyl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-N,N-diethyl-1-[3-(trifluoromethyl)benzyl]piperidin-1-ium-3-carboxamide Formula: C18H26F3N2O+ MolecularWeight: 343.40705

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC[NH+](C1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCN(CC)C(=O)[C@@H]1CCC[NH+](C1)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H25F3N2O/c1-3-23(4-2)17(24)15-8-6-10-22(13-15)12-14-7-5-9-16(11-14)18(19,20)21/h5,7,9,11,15H,3-4,6,8,10,12-13H2,1-2H3/p+1/t15-/m1/s1