2-oxidanyl-2-oxidanylidene-ethanoate; N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butanamide

Systemtic Name: 2-oxidanyl-2-oxidanylidene-ethanoate; N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butanamide Openeye Name: 2-hydroxy-2-oxo-acetate; N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butanamide CAS Name: 2-hydroxy-2-oxoacetate; N-[4-(1-piperidin-1-iumyl)but-2-ynyl]butanamide IUPAC Name: 2-hydroxy-2-oxoacetate; N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butanamide Traditional Name: N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butyramide binoxalate Formula: C15H24N2O5 MolecularWeight: 312.36146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCC#CC[NH+]1CCCCC1.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCC(=O)NCC#CC[NH+]1CCCCC1.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C13H22N2O.C2H2O4/c1-2-8-13(16)14-9-4-7-12-15-10-5-3-6-11-15;3-1(4)2(5)6/h2-3,5-6,8-12H2,1H3,(H,14,16);(H,3,4)(H,5,6)