1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonyl]piperidine-3-carboxylic acid Openeye Name: 1-(3-ethyl-5-methyl-isoxazole-4-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(3-ethyl-5-methyl-4-isoxazolyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(3-ethyl-5-methyl-isoxazole-4-carbonyl)nipecotic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CCCC(C2)C(=O)O)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CCCC(C2)C(=O)O)C

InChI

InChI=1S/C13H18N2O4/c1-3-10-11(8(2)19-14-10)12(16)15-6-4-5-9(7-15)13(17)18/h9H,3-7H2,1-2H3,(H,17,18)