(4-propylphenyl) 3-fluoranyl-4-(5-hexylpyrimidin-2-yl)benzoate

Systemtic Name: (4-propylphenyl) 3-fluoranyl-4-(5-hexylpyrimidin-2-yl)benzoate Openeye Name: (4-propylphenyl) 3-fluoro-4-(5-hexylpyrimidin-2-yl)benzoate CAS Name: 3-fluoro-4-(5-hexyl-2-pyrimidinyl)benzoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 3-fluoro-4-(5-hexylpyrimidin-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-hexylpyrimidin-2-yl)benzoic acid (4-propylphenyl) ester Formula: C26H29FN2O2 MolecularWeight: 420.519063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F

InChI

InChI=1S/C26H29FN2O2/c1-3-5-6-7-9-20-17-28-25(29-18-20)23-15-12-21(16-24(23)27)26(30)31-22-13-10-19(8-4-2)11-14-22/h10-18H,3-9H2,1-2H3