1-(5-ethylfuran-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(5-ethylfuran-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(5-ethylfuran-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(5-ethyl-2-furanyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-ethylfuran-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(5-ethyl-2-furoyl)isonipecotic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCC1=CC=C(O1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H17NO4/c1-2-10-3-4-11(18-10)12(15)14-7-5-9(6-8-14)13(16)17/h3-4,9H,2,5-8H2,1H3,(H,16,17)