1-[[2-(3-methoxypyridin-2-yl)phenyl]methyl]piperidin-1-ium-4-one

Systemtic Name: 1-[[2-(3-methoxypyridin-2-yl)phenyl]methyl]piperidin-1-ium-4-one Openeye Name: 1-[[2-(3-methoxy-2-pyridyl)phenyl]methyl]piperidin-1-ium-4-one CAS Name: 1-[[2-(3-methoxy-2-pyridinyl)phenyl]methyl]-4-piperidin-1-iumone IUPAC Name: 1-[[2-(3-methoxypyridin-2-yl)phenyl]methyl]piperidin-1-ium-4-one Traditional Name: 1-[2-(3-methoxy-2-pyridyl)benzyl]piperidin-1-ium-4-one Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)C2=CC=CC=C2C[NH+]3CCC(=O)CC3

Isomeric SMILES

COC1=C(N=CC=C1)C2=CC=CC=C2C[NH+]3CCC(=O)CC3

InChI

InChI=1S/C18H20N2O2/c1-22-17-7-4-10-19-18(17)16-6-3-2-5-14(16)13-20-11-8-15(21)9-12-20/h2-7,10H,8-9,11-13H2,1H3/p+1