ethyl 1-[(2R)-1-ethylpiperidin-1-ium-2-yl]carbonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2R)-1-ethylpiperidin-1-ium-2-yl]carbonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2R)-1-ethylpiperidin-1-ium-2-carbonyl]-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[[(2R)-1-ethyl-2-piperidin-1-iumyl]-oxomethyl]-4-[(4-methoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2R)-1-ethylpiperidin-1-ium-2-carbonyl]-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(2R)-1-ethylpiperidin-1-ium-2-carbonyl]-4-p-anisyl-isonipecotic acid ethyl ester Formula: C24H37N2O4+ MolecularWeight: 417.56158

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCCC1C(=O)N2CCC(CC2)(CC3=CC=C(C=C3)OC)C(=O)OCC

Isomeric SMILES

CC[NH+]1CCCC[C@@H]1C(=O)N2CCC(CC2)(CC3=CC=C(C=C3)OC)C(=O)OCC

InChI

InChI=1S/C24H36N2O4/c1-4-25-15-7-6-8-21(25)22(27)26-16-13-24(14-17-26,23(28)30-5-2)18-19-9-11-20(29-3)12-10-19/h9-12,21H,4-8,13-18H2,1-3H3/p+1/t21-/m1/s1