1-(2-methylfuran-3-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2-methylfuran-3-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(2-methylfuran-3-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(2-methyl-3-furanyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-methylfuran-3-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-methyl-3-furoyl)isonipecotic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=C(C=CO1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H15NO4/c1-8-10(4-7-17-8)11(14)13-5-2-9(3-6-13)12(15)16/h4,7,9H,2-3,5-6H2,1H3,(H,15,16)