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

Systemtic Name: 2-[[5-[(1S)-1-(4-oxidanylidenepiperidin-1-ium-1-yl)ethyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: 2-[[5-[(1S)-1-(4-oxopiperidin-1-ium-1-yl)ethyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[oxo-[5-[(1S)-1-(4-oxo-1-piperidin-1-iumyl)ethyl]-2-furanyl]methyl]amino]acetate IUPAC Name: 2-[[5-[(1S)-1-(4-oxopiperidin-1-ium-1-yl)ethyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-[(1S)-1-(4-ketopiperidin-1-ium-1-yl)ethyl]-2-furoyl]amino]acetate Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(O1)C(=O)NCC(=O)[O-])[NH+]2CCC(=O)CC2

Isomeric SMILES

C[C@@H](C1=CC=C(O1)C(=O)NCC(=O)[O-])[NH+]2CCC(=O)CC2

InChI

InChI=1S/C14H18N2O5/c1-9(16-6-4-10(17)5-7-16)11-2-3-12(21-11)14(20)15-8-13(18)19/h2-3,9H,4-8H2,1H3,(H,15,20)(H,18,19)/t9-/m0/s1