1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[2-(benzylamino)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[2-(benzylamino)-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(benzylamino)-2-keto-ethyl]piperidin-1-ium-4-carboxylate Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1C(=O)[O-])CC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O3/c18-14(16-10-12-4-2-1-3-5-12)11-17-8-6-13(7-9-17)15(19)20/h1-5,13H,6-11H2,(H,16,18)(H,19,20)