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

Systemtic Name: 1-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl]piperidine-2-carboxylic acid Openeye Name: 1-[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]piperidine-2-carboxylic acid CAS Name: 1-[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-2-carboxylic acid Traditional Name: 1-[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]pipecolinic acid Formula: C17H17ClN2O4 MolecularWeight: 348.78088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N3CCCCC3C(=O)O

InChI

InChI=1S/C17H17ClN2O4/c1-10-14(15(19-24-10)11-6-2-3-7-12(11)18)16(21)20-9-5-4-8-13(20)17(22)23/h2-3,6-7,13H,4-5,8-9H2,1H3,(H,22,23)