1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-ethylbenzyl)piperidin-1-ium-4-carboxylate Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)[O-]

InChI

InChI=1S/C15H21NO2/c1-2-12-3-5-13(6-4-12)11-16-9-7-14(8-10-16)15(17)18/h3-6,14H,2,7-11H2,1H3,(H,17,18)