5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate

Systemtic Name: 5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate Openeye Name: 5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)vinyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylate CAS Name: 5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxyphenoxy]methyl]-2-furancarboxylate IUPAC Name: 5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-2-methoxyphenoxy]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(E)-2-cyano-2-(4-fluorophenyl)vinyl]-2-methoxy-phenoxy]methyl]-2-furoate Formula: C22H15FNO5- MolecularWeight: 392.356603

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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(O3)C(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C#N)\C2=CC=C(C=C2)F)OCC3=CC=C(O3)C(=O)[O-]

InChI

InChI=1S/C22H16FNO5/c1-27-21-11-14(10-16(12-24)15-3-5-17(23)6-4-15)2-8-19(21)28-13-18-7-9-20(29-18)22(25)26/h2-11H,13H2,1H3,(H,25,26)/p-1/b16-10-