2-[2-oxidanylidene-1-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]piperidin-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-1-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]piperidin-1-ium-1-yl]ethanoic acid Openeye Name: 2-[1-[(2-benzyloxy-2-oxo-ethyl)amino]-2-oxo-piperidin-1-ium-1-yl]acetic acid CAS Name: 2-[2-oxo-1-[(2-oxo-2-phenylmethoxyethyl)amino]-1-piperidin-1-iumyl]acetic acid IUPAC Name: 2-[2-oxo-1-[(2-oxo-2-phenylmethoxyethyl)amino]piperidin-1-ium-1-yl]acetic acid Traditional Name: 2-[1-[(2-benzoxy-2-keto-ethyl)amino]-2-keto-piperidin-1-ium-1-yl]acetic acid Formula: C16H21N2O5+ MolecularWeight: 321.34834

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C(=O)C1)(CC(=O)O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC[N+](C(=O)C1)(CC(=O)O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O5/c19-14-8-4-5-9-18(14,11-15(20)21)17-10-16(22)23-12-13-6-2-1-3-7-13/h1-3,6-7,17H,4-5,8-12H2/p+1