N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-3-enamide

Systemtic Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-3-enamide Openeye Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-3-enamide CAS Name: N-[[1-[(2-fluorophenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methoxyethyl)-3-butenamide IUPAC Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-3-enamide Traditional Name: N-[[1-(2-fluorobenzyl)piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)but-3-enamide Formula: C20H30FN2O2+ MolecularWeight: 349.462803

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2F)C(=O)CC=C

Isomeric SMILES

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2F)C(=O)CC=C

InChI

InChI=1S/C20H29FN2O2/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/h3-5,7-8,17H,1,6,9-16H2,2H3/p+1