ethyl (2R)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(3,4-dimethoxyphenyl)methyl]-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-veratrylpiperidin-1-ium-2-carboxylic acid ethyl ester Formula: C17H26NO4+ MolecularWeight: 308.39264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC[NH+]1CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)[C@H]1CCCC[NH+]1CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H25NO4/c1-4-22-17(19)14-7-5-6-10-18(14)12-13-8-9-15(20-2)16(11-13)21-3/h8-9,11,14H,4-7,10,12H2,1-3H3/p+1/t14-/m1/s1