3-carboxy-3,5-bis(oxidanyl)-5-oxidanylidene-pentanoate; (2,2,6,6-tetramethyl-1-oxidanyl-piperidin-1-ium-4-yl) ethanoate

Systemtic Name: 3-carboxy-3,5-bis(oxidanyl)-5-oxidanylidene-pentanoate; (2,2,6,6-tetramethyl-1-oxidanyl-piperidin-1-ium-4-yl) ethanoate Openeye Name: 3-carboxy-3,5-dihydroxy-5-oxo-pentanoate; (1-hydroxy-2,2,6,6-tetramethyl-piperidin-1-ium-4-yl) acetate CAS Name: acetic acid (1-hydroxy-2,2,6,6-tetramethyl-4-piperidin-1-iumyl) ester; 3-carboxy-3,5-dihydroxy-5-oxopentanoate IUPAC Name: 3-carboxy-3,5-dihydroxy-5-oxopentanoate; (1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl) acetate Traditional Name: acetic acid (1-hydroxy-2,2,6,6-tetramethyl-piperidin-1-ium-4-yl) ester; 3-carboxy-3,5-dihydroxy-5-keto-valerate Formula: C17H29NO10 MolecularWeight: 407.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC([NH+](C(C1)(C)C)O)(C)C.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O

Isomeric SMILES

CC(=O)OC1CC([NH+](C(C1)(C)C)O)(C)C.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O

InChI

InChI=1S/C11H21NO3.C6H8O7/c1-8(13)15-9-6-10(2,3)12(14)11(4,5)7-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h9,14H,6-7H2,1-5H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)