(2R,3S)-2-(furan-2-yl)-6-oxidanylidene-1-phenyl-piperidine-3-carboxylic acid

Systemtic Name: (2R,3S)-2-(furan-2-yl)-6-oxidanylidene-1-phenyl-piperidine-3-carboxylic acid Openeye Name: (2R,3S)-2-(2-furyl)-6-oxo-1-phenyl-piperidine-3-carboxylic acid CAS Name: (2R,3S)-2-(2-furanyl)-6-oxo-1-phenyl-3-piperidinecarboxylic acid IUPAC Name: (2R,3S)-2-(furan-2-yl)-6-oxo-1-phenylpiperidine-3-carboxylic acid Traditional Name: (2R,3S)-2-(2-furyl)-6-keto-1-phenyl-nipecotic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(C1C(=O)O)C2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N([C@H]([C@H]1C(=O)O)C2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C16H15NO4/c18-14-9-8-12(16(19)20)15(13-7-4-10-21-13)17(14)11-5-2-1-3-6-11/h1-7,10,12,15H,8-9H2,(H,19,20)/t12-,15+/m0/s1