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

Systemtic Name: ethyl 1-[(6-methylpyridin-2-yl)methyl]-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(6-methyl-2-pyridyl)methyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-4-[[(2R)-2-oxanyl]methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-methylpyridin-2-yl)methyl]-4-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(6-methyl-2-pyridyl)methyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=CC(=N2)C)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=CC(=N2)C)C[C@H]3CCCCO3

InChI

InChI=1S/C21H32N2O3/c1-3-25-20(24)21(15-19-9-4-5-14-26-19)10-12-23(13-11-21)16-18-8-6-7-17(2)22-18/h6-8,19H,3-5,9-16H2,1-2H3/p+1/t19-/m1/s1