2-[[5-[(4-oxidanylidenepiperidin-1-ium-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[5-[(4-oxidanylidenepiperidin-1-ium-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: 2-[[5-[(4-oxopiperidin-1-ium-1-yl)methyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[oxo-[5-[(4-oxo-1-piperidin-1-iumyl)methyl]-2-furanyl]methyl]amino]acetate IUPAC Name: 2-[[5-[(4-oxopiperidin-1-ium-1-yl)methyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-[(4-ketopiperidin-1-ium-1-yl)methyl]-2-furoyl]amino]acetate Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=O)CC2=CC=C(O2)C(=O)NCC(=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1=O)CC2=CC=C(O2)C(=O)NCC(=O)[O-]

InChI

InChI=1S/C13H16N2O5/c16-9-3-5-15(6-4-9)8-10-1-2-11(20-10)13(19)14-7-12(17)18/h1-2H,3-8H2,(H,14,19)(H,17,18)