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

Systemtic Name: (4-pentylcyclohexyl) 2-fluoranyl-4-(5-pentylpyrimidin-2-yl)benzoate Openeye Name: (4-pentylcyclohexyl) 2-fluoro-4-(5-pentylpyrimidin-2-yl)benzoate CAS Name: 2-fluoro-4-(5-pentyl-2-pyrimidinyl)benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 2-fluoro-4-(5-pentylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-amylpyrimidin-2-yl)-2-fluoro-benzoic acid (4-amylcyclohexyl) ester Formula: C27H37FN2O2 MolecularWeight: 440.593283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCC)F

InChI

InChI=1S/C27H37FN2O2/c1-3-5-7-9-20-11-14-23(15-12-20)32-27(31)24-16-13-22(17-25(24)28)26-29-18-21(19-30-26)10-8-6-4-2/h13,16-20,23H,3-12,14-15H2,1-2H3