1-octyl-6-oxidanylidene-piperidine-2-carboxylic acid

Systemtic Name: 1-octyl-6-oxidanylidene-piperidine-2-carboxylic acid Openeye Name: 1-octyl-6-oxo-piperidine-2-carboxylic acid CAS Name: 1-octyl-6-oxo-2-piperidinecarboxylic acid IUPAC Name: 1-octyl-6-oxopiperidine-2-carboxylic acid Traditional Name: 6-keto-1-octyl-pipecolinic acid Formula: C14H25NO3 MolecularWeight: 255.3532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(CCCC1=O)C(=O)O

Isomeric SMILES

CCCCCCCCN1C(CCCC1=O)C(=O)O

InChI

InChI=1S/C14H25NO3/c1-2-3-4-5-6-7-11-15-12(14(17)18)9-8-10-13(15)16/h12H,2-11H2,1H3,(H,17,18)