N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide Traditional Name: N-(4-fluorobenzyl)-3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propionamide Formula: C21H27FN3O+ MolecularWeight: 356.456983

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)NCC2=CC=C(C=C2)F)CC3=CC=NC=C3

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)NCC2=CC=C(C=C2)F)CC3=CC=NC=C3

InChI

InChI=1S/C21H26FN3O/c22-20-4-1-18(2-5-20)15-24-21(26)6-3-17-9-13-25(14-10-17)16-19-7-11-23-12-8-19/h1-2,4-5,7-8,11-12,17H,3,6,9-10,13-16H2,(H,24,26)/p+1