methyl 2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanoate

Systemtic Name: methyl 2-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanoate Openeye Name: methyl 2-(1-benzylpiperidin-1-ium-4-yl)acetate CAS Name: 2-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-(1-benzylpiperidin-1-ium-4-yl)acetate Traditional Name: 2-(1-benzylpiperidin-1-ium-4-yl)acetic acid methyl ester Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c1-18-15(17)11-13-7-9-16(10-8-13)12-14-5-3-2-4-6-14/h2-6,13H,7-12H2,1H3/p+1