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

Systemtic Name: 1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]piperidine-3-carboxylic acid Openeye Name: 1-(5-methylisoxazole-3-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(5-methyl-3-isoxazolyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(5-methyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(5-methylisoxazole-3-carbonyl)nipecotic acid Formula: C11H14N2O4 MolecularWeight: 238.23986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC1=CC(=NO1)C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C11H14N2O4/c1-7-5-9(12-17-7)10(14)13-4-2-3-8(6-13)11(15)16/h5,8H,2-4,6H2,1H3,(H,15,16)