4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxy-phenoxy]methyl]benzoate

Systemtic Name: 4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxy-phenoxy]methyl]benzoate Openeye Name: 4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)vinyl]-2-methoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxyphenoxy]methyl]benzoate IUPAC Name: 4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxyphenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-2-cyano-2-(4-fluorophenyl)vinyl]-2-methoxy-phenoxy]methyl]benzoate Formula: C24H17FNO4- MolecularWeight: 402.394483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)F)OCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C#N)\C2=CC=C(C=C2)F)OCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C24H18FNO4/c1-29-23-13-17(12-20(14-26)18-7-9-21(25)10-8-18)4-11-22(23)30-15-16-2-5-19(6-3-16)24(27)28/h2-13H,15H2,1H3,(H,27,28)/p-1/b20-12-