4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]benzoate

Systemtic Name: 4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]benzoate Openeye Name: 4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]benzoate CAS Name: 4-[(4-hydroxy-1-piperidin-1-iumyl)methyl]benzoate IUPAC Name: 4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]benzoate Traditional Name: 4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]benzoate Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1O)CC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H17NO3/c15-12-5-7-14(8-6-12)9-10-1-3-11(4-2-10)13(16)17/h1-4,12,15H,5-9H2,(H,16,17)