N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-2-ynamide

Systemtic Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-2-ynamide Openeye Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-2-ynamide CAS Name: N-[[1-[(2-fluorophenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methoxyethyl)-2-butynamide IUPAC Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-2-ynamide Traditional Name: N-[[1-(2-fluorobenzyl)piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-2-ynamide Formula: C20H28FN2O2+ MolecularWeight: 347.446923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N(CCOC)CC1CC[NH+](CC1)CC2=CC=CC=C2F

Isomeric SMILES

CC#CC(=O)N(CCOC)CC1CC[NH+](CC1)CC2=CC=CC=C2F

InChI

InChI=1S/C20H27FN2O2/c1-3-6-20(24)23(13-14-25-2)15-17-9-11-22(12-10-17)16-18-7-4-5-8-19(18)21/h4-5,7-8,17H,9-16H2,1-2H3/p+1