1-[2,2,2-tris(fluoranyl)ethoxycarbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2,2,2-tris(fluoranyl)ethoxycarbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(2,2,2-trifluoroethoxycarbonyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo(2,2,2-trifluoroethoxy)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2,2,2-trifluoroethoxycarbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(2,2,2-trifluoroethoxycarbonyl)isonipecotic acid Formula: C9H12F3NO4 MolecularWeight: 255.19109

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)OCC(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)OCC(F)(F)F

InChI

InChI=1S/C9H12F3NO4/c10-9(11,12)5-17-8(16)13-3-1-6(2-4-13)7(14)15/h6H,1-5H2,(H,14,15)