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

Systemtic Name: [4-[(E)-2-cyano-3-(furan-2-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-2-cyano-3-(2-furyl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-3-(2-furanyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(furan-2-yl)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-3-(2-furyl)-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=CO2)OC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CO2)OC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H14FNO5/c1-27-20-12-14(11-16(13-24)21(25)19-3-2-10-28-19)4-9-18(20)29-22(26)15-5-7-17(23)8-6-15/h2-12H,1H3/b16-11+