[4-(5-decylpyrimidin-2-yl)phenyl] 2-fluoranyloctanoate

Systemtic Name: [4-(5-decylpyrimidin-2-yl)phenyl] 2-fluoranyloctanoate Openeye Name: [4-(5-decylpyrimidin-2-yl)phenyl] 2-fluorooctanoate CAS Name: 2-fluorooctanoic acid [4-(5-decyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-decylpyrimidin-2-yl)phenyl] 2-fluorooctanoate Traditional Name: 2-fluorocaprylic acid [4-(5-decylpyrimidin-2-yl)phenyl] ester Formula: C28H41FN2O2 MolecularWeight: 456.635743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCCCCC)F

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C(CCCCCC)F

InChI

InChI=1S/C28H41FN2O2/c1-3-5-7-9-10-11-12-13-15-23-21-30-27(31-22-23)24-17-19-25(20-18-24)33-28(32)26(29)16-14-8-6-4-2/h17-22,26H,3-16H2,1-2H3