1-ethyl-1-(2-oxidanylidenebutanoyl)piperidin-1-ium-2-carboxylic acid

Systemtic Name: 1-ethyl-1-(2-oxidanylidenebutanoyl)piperidin-1-ium-2-carboxylic acid Openeye Name: 1-ethyl-1-(2-oxobutanoyl)piperidin-1-ium-2-carboxylic acid CAS Name: 1-(1,2-dioxobutyl)-1-ethyl-2-piperidin-1-iumcarboxylic acid IUPAC Name: 1-ethyl-1-(2-oxobutanoyl)piperidin-1-ium-2-carboxylic acid Traditional Name: 1-ethyl-1-(2-ketobutanoyl)piperidin-1-ium-2-carboxylic acid Formula: C12H20NO4+ MolecularWeight: 242.2915

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)[N+]1(CCCCC1C(=O)O)CC

Isomeric SMILES

CCC(=O)C(=O)[N+]1(CCCCC1C(=O)O)CC

InChI

InChI=1S/C12H19NO4/c1-3-10(14)11(15)13(4-2)8-6-5-7-9(13)12(16)17/h9H,3-8H2,1-2H3/p+1