1-[(4-ethoxy-3-methoxy-phenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[(4-ethoxy-3-methoxy-phenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-ethoxy-3-methoxy-benzyl)piperidin-1-ium-4-carboxylate Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-])OC

InChI

InChI=1S/C16H23NO4/c1-3-21-14-5-4-12(10-15(14)20-2)11-17-8-6-13(7-9-17)16(18)19/h4-5,10,13H,3,6-9,11H2,1-2H3,(H,18,19)