N,N-dimethyl-4-[1-prop-2-ynyl-1-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium-4-yl]aniline

Systemtic Name: N,N-dimethyl-4-[1-prop-2-ynyl-1-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium-4-yl]aniline Openeye Name: N,N-dimethyl-4-[1-prop-2-ynyl-1-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium-4-yl]aniline CAS Name: N,N-dimethyl-4-[1-prop-2-ynyl-1-[[4-(trifluoromethyl)phenoxy]methyl]-4-piperidin-1-iumyl]aniline IUPAC Name: N,N-dimethyl-4-[1-prop-2-ynyl-1-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium-4-yl]aniline Traditional Name: dimethyl-[4-[1-propargyl-1-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-1-ium-4-yl]phenyl]amine Formula: C24H28F3N2O+ MolecularWeight: 417.48713

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2CC[N+](CC2)(CC#C)COC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2CC[N+](CC2)(CC#C)COC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C24H28F3N2O/c1-4-15-29(18-30-23-11-7-21(8-12-23)24(25,26)27)16-13-20(14-17-29)19-5-9-22(10-6-19)28(2)3/h1,5-12,20H,13-18H2,2-3H3/q+1