[4-[(E)-2-cyano-3-(2-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate

Systemtic Name: [4-[(E)-2-cyano-3-(2-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[(E)-2-cyano-3-(2-fluorophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(E)-2-cyano-3-(2-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(E)-2-cyano-3-(2-fluorophenyl)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C22H14FNO5 MolecularWeight: 391.348663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=CC=C2F)OC(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2F)OC(=O)C3=CC=CO3

InChI

InChI=1S/C22H14FNO5/c1-27-20-12-14(8-9-18(20)29-22(26)19-7-4-10-28-19)11-15(13-24)21(25)16-5-2-3-6-17(16)23/h2-12H,1H3/b15-11+