ethyl (2R)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(2-hydroxyphenyl)methyl]-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-salicylpiperidin-1-ium-2-carboxylic acid ethyl ester Formula: C15H22NO3+ MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC[NH+]1CC2=CC=CC=C2O

Isomeric SMILES

CCOC(=O)[C@H]1CCCC[NH+]1CC2=CC=CC=C2O

InChI

InChI=1S/C15H21NO3/c1-2-19-15(18)13-8-5-6-10-16(13)11-12-7-3-4-9-14(12)17/h3-4,7,9,13,17H,2,5-6,8,10-11H2,1H3/p+1/t13-/m1/s1