ethyl 4-[(3-methoxyphenyl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 4-[(3-methoxyphenyl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 4-m-anisyl-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=CC(=N2)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=CC(=N2)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C23H30N2O3/c1-4-28-22(26)23(16-19-8-6-10-21(15-19)27-3)11-13-25(14-12-23)17-20-9-5-7-18(2)24-20/h5-10,15H,4,11-14,16-17H2,1-3H3/p+1