[4-[4-(5-octoxypyrimidin-2-yl)phenyl]phenyl] 3-fluoranylpentanoate

Systemtic Name: [4-[4-(5-octoxypyrimidin-2-yl)phenyl]phenyl] 3-fluoranylpentanoate Openeye Name: [4-[4-(5-octoxypyrimidin-2-yl)phenyl]phenyl] 3-fluoropentanoate CAS Name: 3-fluoropentanoic acid [4-[4-(5-octoxy-2-pyrimidinyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(5-octoxypyrimidin-2-yl)phenyl]phenyl] 3-fluoropentanoate Traditional Name: 3-fluorovaleric acid [4-[4-(5-octoxypyrimidin-2-yl)phenyl]phenyl] ester Formula: C29H35FN2O3 MolecularWeight: 478.598203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CC(CC)F

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CC(CC)F

InChI

InChI=1S/C29H35FN2O3/c1-3-5-6-7-8-9-18-34-27-20-31-29(32-21-27)24-12-10-22(11-13-24)23-14-16-26(17-15-23)35-28(33)19-25(30)4-2/h10-17,20-21,25H,3-9,18-19H2,1-2H3