3-acetamido-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-propanamide

Systemtic Name: 3-acetamido-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-propanamide Openeye Name: 3-acetamido-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-propanamide CAS Name: 3-acetamido-N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-N-methylpropanamide IUPAC Name: 3-acetamido-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methylpropanamide Traditional Name: 3-acetamido-N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-N-methyl-propionamide Formula: C18H27FN3O2+ MolecularWeight: 336.424283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)N(C)C1CCC[NH+](C1)CC2=CC=CC=C2F

Isomeric SMILES

CC(=O)NCCC(=O)N(C)[C@H]1CCC[NH+](C1)CC2=CC=CC=C2F

InChI

InChI=1S/C18H26FN3O2/c1-14(23)20-10-9-18(24)21(2)16-7-5-11-22(13-16)12-15-6-3-4-8-17(15)19/h3-4,6,8,16H,5,7,9-13H2,1-2H3,(H,20,23)/p+1/t16-/m0/s1