1-[(2,2,5-trimethyl-1,3-dioxan-5-yl)carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2,2,5-trimethyl-1,3-dioxan-5-yl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(2,2,5-trimethyl-1,3-dioxane-5-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(2,2,5-trimethyl-1,3-dioxan-5-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2,2,5-trimethyl-1,3-dioxane-5-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(2,2,5-trimethyl-1,3-dioxane-5-carbonyl)isonipecotic acid Formula: C14H23NO5 MolecularWeight: 285.33612

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(C)C(=O)N2CCC(CC2)C(=O)O)C

Isomeric SMILES

CC1(OCC(CO1)(C)C(=O)N2CCC(CC2)C(=O)O)C

InChI

InChI=1S/C14H23NO5/c1-13(2)19-8-14(3,9-20-13)12(18)15-6-4-10(5-7-15)11(16)17/h10H,4-9H2,1-3H3,(H,16,17)