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

Systemtic Name: (4-pentylcyclohexyl) 4-(5-butylpyrimidin-2-yl)-2-fluoranyl-benzoate Openeye Name: (4-pentylcyclohexyl) 4-(5-butylpyrimidin-2-yl)-2-fluoro-benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)-2-fluorobenzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-(5-butylpyrimidin-2-yl)-2-fluorobenzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)-2-fluoro-benzoic acid (4-amylcyclohexyl) ester Formula: C26H35FN2O2 MolecularWeight: 426.566703

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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)CCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C26H35FN2O2/c1-3-5-7-9-19-10-13-22(14-11-19)31-26(30)23-15-12-21(16-24(23)27)25-28-17-20(18-29-25)8-6-4-2/h12,15-19,22H,3-11,13-14H2,1-2H3