1-methyl-N-[[2-(2-methylphenoxy)pyridin-3-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-methyl-N-[[2-(2-methylphenoxy)pyridin-3-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-methyl-N-[[2-(2-methylphenoxy)-3-pyridyl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-methyl-N-[[2-(2-methylphenoxy)pyridin-3-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-methyl-N-[[2-(2-methylphenoxy)-3-pyridyl]methyl]piperidin-1-ium-4-carboxamide Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=C(C=CC=N2)CNC(=O)C3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CC=C1OC2=C(C=CC=N2)CNC(=O)C3CC[NH+](CC3)C

InChI

InChI=1S/C20H25N3O2/c1-15-6-3-4-8-18(15)25-20-17(7-5-11-21-20)14-22-19(24)16-9-12-23(2)13-10-16/h3-8,11,16H,9-10,12-14H2,1-2H3,(H,22,24)/p+1