2,2,3,3-tetrakis(fluoranyl)propyl 3-[4-(5-pentylpyrimidin-2-yl)phenyl]propanoate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl 3-[4-(5-pentylpyrimidin-2-yl)phenyl]propanoate Openeye Name: 2,2,3,3-tetrafluoropropyl 3-[4-(5-pentylpyrimidin-2-yl)phenyl]propanoate CAS Name: 3-[4-(5-pentyl-2-pyrimidinyl)phenyl]propanoic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl 3-[4-(5-pentylpyrimidin-2-yl)phenyl]propanoate Traditional Name: 3-[4-(5-amylpyrimidin-2-yl)phenyl]propionic acid 2,2,3,3-tetrafluoropropyl ester Formula: C21H24F4N2O2 MolecularWeight: 412.421073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCC(=O)OCC(C(F)F)(F)F

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CCC(=O)OCC(C(F)F)(F)F

InChI

InChI=1S/C21H24F4N2O2/c1-2-3-4-5-16-12-26-19(27-13-16)17-9-6-15(7-10-17)8-11-18(28)29-14-21(24,25)20(22)23/h6-7,9-10,12-13,20H,2-5,8,11,14H2,1H3