2,2,3,3-tetrakis(fluoranyl)propyl (E)-3-[4-(5-hexylpyrimidin-2-yl)phenyl]prop-2-enoate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl (E)-3-[4-(5-hexylpyrimidin-2-yl)phenyl]prop-2-enoate Openeye Name: 2,2,3,3-tetrafluoropropyl (E)-3-[4-(5-hexylpyrimidin-2-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(5-hexyl-2-pyrimidinyl)phenyl]-2-propenoic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl (E)-3-[4-(5-hexylpyrimidin-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(5-hexylpyrimidin-2-yl)phenyl]acrylic acid 2,2,3,3-tetrafluoropropyl ester Formula: C22H24F4N2O2 MolecularWeight: 424.431773

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C=CC(=O)OCC(C(F)F)(F)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)/C=C/C(=O)OCC(C(F)F)(F)F

InChI

InChI=1S/C22H24F4N2O2/c1-2-3-4-5-6-17-13-27-20(28-14-17)18-10-7-16(8-11-18)9-12-19(29)30-15-22(25,26)21(23)24/h7-14,21H,2-6,15H2,1H3/b12-9+