1-(2-oxidanyl-2-phenyl-ethanoyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(2-oxidanyl-2-phenyl-ethanoyl)piperidine-3-carboxylic acid Openeye Name: 1-(2-hydroxy-2-phenyl-acetyl)piperidine-3-carboxylic acid CAS Name: 1-(2-hydroxy-1-oxo-2-phenylethyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(2-hydroxy-2-phenylacetyl)piperidine-3-carboxylic acid Traditional Name: 1-mandeloylnipecotic acid Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C(C2=CC=CC=C2)O)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C(C2=CC=CC=C2)O)C(=O)O

InChI

InChI=1S/C14H17NO4/c16-12(10-5-2-1-3-6-10)13(17)15-8-4-7-11(9-15)14(18)19/h1-3,5-6,11-12,16H,4,7-9H2,(H,18,19)