[4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]cyclohexyl] 2-fluoranylhexanoate

Systemtic Name: [4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]cyclohexyl] 2-fluoranylhexanoate Openeye Name: [4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]cyclohexyl] 2-fluorohexanoate CAS Name: 2-fluorohexanoic acid [4-[[4-(5-nonyl-2-pyrimidinyl)phenoxy]methyl]cyclohexyl] ester IUPAC Name: [4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]cyclohexyl] 2-fluorohexanoate Traditional Name: 2-fluorohexanoic acid [4-[[4-(5-nonylpyrimidin-2-yl)phenoxy]methyl]cyclohexyl] ester Formula: C32H47FN2O3 MolecularWeight: 526.725583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3CCC(CC3)OC(=O)C(CCCC)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3CCC(CC3)OC(=O)C(CCCC)F

InChI

InChI=1S/C32H47FN2O3/c1-3-5-7-8-9-10-11-12-26-22-34-31(35-23-26)27-16-20-28(21-17-27)37-24-25-14-18-29(19-15-25)38-32(36)30(33)13-6-4-2/h16-17,20-23,25,29-30H,3-15,18-19,24H2,1-2H3