(4-pentylcyclohexyl) 2-fluoranyl-4-(5-hexylpyrimidin-2-yl)benzoate

Systemtic Name: (4-pentylcyclohexyl) 2-fluoranyl-4-(5-hexylpyrimidin-2-yl)benzoate Openeye Name: (4-pentylcyclohexyl) 2-fluoro-4-(5-hexylpyrimidin-2-yl)benzoate CAS Name: 2-fluoro-4-(5-hexyl-2-pyrimidinyl)benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 2-fluoro-4-(5-hexylpyrimidin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-hexylpyrimidin-2-yl)benzoic acid (4-amylcyclohexyl) ester Formula: C28H39FN2O2 MolecularWeight: 454.619863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3CCC(CC3)CCCCC)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3CCC(CC3)CCCCC)F

InChI

InChI=1S/C28H39FN2O2/c1-3-5-7-9-11-22-19-30-27(31-20-22)23-14-17-25(26(29)18-23)28(32)33-24-15-12-21(13-16-24)10-8-6-4-2/h14,17-21,24H,3-13,15-16H2,1-2H3