2-(1-phenethylpiperidin-1-ium-4-yl)ethanoate

Systemtic Name: 2-(1-phenethylpiperidin-1-ium-4-yl)ethanoate Openeye Name: 2-(1-phenethylpiperidin-1-ium-4-yl)acetate CAS Name: 2-(1-phenethyl-4-piperidin-1-iumyl)acetate IUPAC Name: 2-(1-phenethylpiperidin-1-ium-4-yl)acetate Traditional Name: 2-(1-phenethylpiperidin-1-ium-4-yl)acetate Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC(=O)[O-])CCC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1CC(=O)[O-])CCC2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c17-15(18)12-14-7-10-16(11-8-14)9-6-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,18)