1-[5-fluoranyl-6-(fluoranylmethyl)pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: 1-[5-fluoranyl-6-(fluoranylmethyl)pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: 1-[5-fluoro-6-(fluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-fluoro-6-(fluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxylate IUPAC Name: 1-[5-fluoro-6-(fluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-fluoro-6-(fluoromethyl)pyrimidin-4-yl]isonipecotate Formula: C11H12F2N3O2- MolecularWeight: 256.228686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=NC=NC(=C2F)CF

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=NC=NC(=C2F)CF

InChI

InChI=1S/C11H13F2N3O2/c12-5-8-9(13)10(15-6-14-8)16-3-1-7(2-4-16)11(17)18/h6-7H,1-5H2,(H,17,18)/p-1