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

Systemtic Name: (2S,3R)-2-(furan-2-yl)-1-(2-methylpropyl)-6-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: (2S,3R)-2-(2-furyl)-1-isobutyl-6-oxo-piperidine-3-carboxylic acid CAS Name: (2S,3R)-2-(2-furanyl)-1-(2-methylpropyl)-6-oxo-3-piperidinecarboxylic acid IUPAC Name: (2S,3R)-2-(furan-2-yl)-1-(2-methylpropyl)-6-oxopiperidine-3-carboxylic acid Traditional Name: (2S,3R)-2-(2-furyl)-1-isobutyl-6-keto-nipecotic acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(C(CCC1=O)C(=O)O)C2=CC=CO2

Isomeric SMILES

CC(C)CN1[C@@H]([C@@H](CCC1=O)C(=O)O)C2=CC=CO2

InChI

InChI=1S/C14H19NO4/c1-9(2)8-15-12(16)6-5-10(14(17)18)13(15)11-4-3-7-19-11/h3-4,7,9-10,13H,5-6,8H2,1-2H3,(H,17,18)/t10-,13+/m1/s1