ethyl (3S)-3-(2-methoxyethyl)-1-(oxan-4-yl)piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-3-(2-methoxyethyl)-1-(oxan-4-yl)piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-3-(2-methoxyethyl)-1-tetrahydropyran-4-yl-piperidin-1-ium-3-carboxylate CAS Name: (3S)-3-(2-methoxyethyl)-1-(4-oxanyl)-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-(2-methoxyethyl)-1-(oxan-4-yl)piperidin-1-ium-3-carboxylate Traditional Name: (3S)-3-(2-methoxyethyl)-1-tetrahydropyran-4-yl-piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C16H30NO4+ MolecularWeight: 300.4137

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC[NH+](C1)C2CCOCC2)CCOC

Isomeric SMILES

CCOC(=O)[C@@]1(CCC[NH+](C1)C2CCOCC2)CCOC

InChI

InChI=1S/C16H29NO4/c1-3-21-15(18)16(8-12-19-2)7-4-9-17(13-16)14-5-10-20-11-6-14/h14H,3-13H2,1-2H3/p+1/t16-/m0/s1