1-[3,3,3-tris(fluoranyl)propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3,3,3-tris(fluoranyl)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-(3,3,3-trifluoropropanoyl)piperidine-4-carboxylic acid CAS Name: 1-(3,3,3-trifluoro-1-oxopropyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(3,3,3-trifluoropropanoyl)piperidine-4-carboxylic acid Traditional Name: 1-(3,3,3-trifluoropropanoyl)isonipecotic acid Formula: C9H12F3NO3 MolecularWeight: 239.19169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12F3NO3/c10-9(11,12)5-7(14)13-3-1-6(2-4-13)8(15)16/h6H,1-5H2,(H,15,16)