1-(6-oxidanylidenepyran-3-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(6-oxidanylidenepyran-3-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(6-oxopyran-3-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(6-oxo-3-pyranyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(6-oxopyran-3-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(6-ketopyran-3-carbonyl)isonipecotic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=COC(=O)C=C2

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=COC(=O)C=C2

InChI

InChI=1S/C12H13NO5/c14-10-2-1-9(7-18-10)11(15)13-5-3-8(4-6-13)12(16)17/h1-2,7-8H,3-6H2,(H,16,17)