2-(2-tert-butyl-4-fluoranyl-pyrimidin-5-yl)-3-methyl-butanoate

Systemtic Name: 2-(2-tert-butyl-4-fluoranyl-pyrimidin-5-yl)-3-methyl-butanoate Openeye Name: 2-(2-tert-butyl-4-fluoro-pyrimidin-5-yl)-3-methyl-butanoate CAS Name: 2-(2-tert-butyl-4-fluoro-5-pyrimidinyl)-3-methylbutanoate IUPAC Name: 2-(2-tert-butyl-4-fluoropyrimidin-5-yl)-3-methylbutanoate Traditional Name: 2-(2-tert-butyl-4-fluoro-pyrimidin-5-yl)-3-methyl-butyrate Formula: C13H18FN2O2- MolecularWeight: 253.292623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CN=C(N=C1F)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)C(C1=CN=C(N=C1F)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C13H19FN2O2/c1-7(2)9(11(17)18)8-6-15-12(13(3,4)5)16-10(8)14/h6-7,9H,1-5H3,(H,17,18)/p-1