1-(phenylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: 1-(phenylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: 1-benzylpiperidin-1-ium-4-carboxylate CAS Name: 1-(phenylmethyl)-4-piperidin-1-iumcarboxylate IUPAC Name: 1-benzylpiperidin-1-ium-4-carboxylate Traditional Name: 1-benzylpiperidin-1-ium-4-carboxylate Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1C(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C13H17NO2/c15-13(16)12-6-8-14(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,15,16)