1-[2-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-[2-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(trifluoromethyl)pyrimidin-4-yl]isonipecotic acid Formula: C11H12F3N3O2 MolecularWeight: 275.22709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12F3N3O2/c12-11(13,14)10-15-4-1-8(16-10)17-5-2-7(3-6-17)9(18)19/h1,4,7H,2-3,5-6H2,(H,18,19)