1-[[2-(8-methoxyquinolin-2-yl)phenyl]methyl]piperidin-1-ium-4-one

Systemtic Name: 1-[[2-(8-methoxyquinolin-2-yl)phenyl]methyl]piperidin-1-ium-4-one Openeye Name: 1-[[2-(8-methoxy-2-quinolyl)phenyl]methyl]piperidin-1-ium-4-one CAS Name: 1-[[2-(8-methoxy-2-quinolinyl)phenyl]methyl]-4-piperidin-1-iumone IUPAC Name: 1-[[2-(8-methoxyquinolin-2-yl)phenyl]methyl]piperidin-1-ium-4-one Traditional Name: 1-[2-(8-methoxy-2-quinolyl)benzyl]piperidin-1-ium-4-one Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(C=C2)C3=CC=CC=C3C[NH+]4CCC(=O)CC4

Isomeric SMILES

COC1=CC=CC2=C1N=C(C=C2)C3=CC=CC=C3C[NH+]4CCC(=O)CC4

InChI

InChI=1S/C22H22N2O2/c1-26-21-8-4-6-16-9-10-20(23-22(16)21)19-7-3-2-5-17(19)15-24-13-11-18(25)12-14-24/h2-10H,11-15H2,1H3/p+1