1-[2,3,4-tris(fluoranyl)phenyl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[2,3,4-tris(fluoranyl)phenyl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(2,3,4-trifluorobenzoyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(2,3,4-trifluorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2,3,4-trifluorobenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(2,3,4-trifluorobenzoyl)isonipecotic acid Formula: C13H12F3NO3 MolecularWeight: 287.23449

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C13H12F3NO3/c14-9-2-1-8(10(15)11(9)16)12(18)17-5-3-7(4-6-17)13(19)20/h1-2,7H,3-6H2,(H,19,20)