[4-cyano-3,5-bis(fluoranyl)phenyl] 4-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]benzoate

Systemtic Name: [4-cyano-3,5-bis(fluoranyl)phenyl] 4-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]benzoate Openeye Name: (4-cyano-3,5-difluoro-phenyl) 4-[(E)-2-(4-allyloxyphenyl)vinyl]benzoate CAS Name: 4-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]benzoic acid (4-cyano-3,5-difluorophenyl) ester IUPAC Name: (4-cyano-3,5-difluorophenyl) 4-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(4-allyloxyphenyl)vinyl]benzoic acid (4-cyano-3,5-difluoro-phenyl) ester Formula: C25H17F2NO3 MolecularWeight: 417.404186

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)C#N)F

Isomeric SMILES

C=CCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)C#N)F

InChI

InChI=1S/C25H17F2NO3/c1-2-13-30-20-11-7-18(8-12-20)4-3-17-5-9-19(10-6-17)25(29)31-21-14-23(26)22(16-28)24(27)15-21/h2-12,14-15H,1,13H2/b4-3+