tert-butyl 1-[(3-ethoxycarbonylphenyl)methoxy]piperidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[(3-ethoxycarbonylphenyl)methoxy]piperidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[(3-ethoxycarbonylphenyl)methoxy]piperidin-1-ium-1-carboxylate CAS Name: 1-[(3-ethoxycarbonylphenyl)methoxy]-1-piperidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(3-ethoxycarbonylphenyl)methoxy]piperidin-1-ium-1-carboxylate Traditional Name: 1-(3-carbethoxybenzyl)oxypiperidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C20H30NO5+ MolecularWeight: 364.4559

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)CO[N+]2(CCCCC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)CO[N+]2(CCCCC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H30NO5/c1-5-24-18(22)17-11-9-10-16(14-17)15-25-21(12-7-6-8-13-21)19(23)26-20(2,3)4/h9-11,14H,5-8,12-13,15H2,1-4H3/q+1