2-[[2,2-dimethyl-3-(4-oxidanylidenepiperidin-1-ium-1-yl)propanoyl]amino]ethanoate

Systemtic Name: 2-[[2,2-dimethyl-3-(4-oxidanylidenepiperidin-1-ium-1-yl)propanoyl]amino]ethanoate Openeye Name: 2-[[2,2-dimethyl-3-(4-oxopiperidin-1-ium-1-yl)propanoyl]amino]acetate CAS Name: 2-[[2,2-dimethyl-1-oxo-3-(4-oxo-1-piperidin-1-iumyl)propyl]amino]acetate IUPAC Name: 2-[[2,2-dimethyl-3-(4-oxopiperidin-1-ium-1-yl)propanoyl]amino]acetate Traditional Name: 2-[[3-(4-ketopiperidin-1-ium-1-yl)-2,2-dimethyl-propanoyl]amino]acetate Formula: C12H20N2O4 MolecularWeight: 256.2982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCC(=O)CC1)C(=O)NCC(=O)[O-]

Isomeric SMILES

CC(C)(C[NH+]1CCC(=O)CC1)C(=O)NCC(=O)[O-]

InChI

InChI=1S/C12H20N2O4/c1-12(2,11(18)13-7-10(16)17)8-14-5-3-9(15)4-6-14/h3-8H2,1-2H3,(H,13,18)(H,16,17)