(5-hexylpyrimidin-2-yl) 4-fluoranylbenzoate

Systemtic Name: (5-hexylpyrimidin-2-yl) 4-fluoranylbenzoate Openeye Name: (5-hexylpyrimidin-2-yl) 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid (5-hexyl-2-pyrimidinyl) ester IUPAC Name: (5-hexylpyrimidin-2-yl) 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid (5-hexylpyrimidin-2-yl) ester Formula: C17H19FN2O2 MolecularWeight: 302.343363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)OC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)OC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN2O2/c1-2-3-4-5-6-13-11-19-17(20-12-13)22-16(21)14-7-9-15(18)10-8-14/h7-12H,2-6H2,1H3