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

Systemtic Name: [4-[(E)-2-cyano-3-(2-methylfuran-3-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-2-cyano-3-(2-methyl-3-furyl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-3-(2-methyl-3-furanyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2-methylfuran-3-yl)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-2-cyano-3-keto-3-(2-methyl-3-furyl)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C23H16FNO5 MolecularWeight: 405.375243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)C#N

Isomeric SMILES

CC1=C(C=CO1)C(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)F)OC)/C#N

InChI

InChI=1S/C23H16FNO5/c1-14-19(9-10-29-14)22(26)17(13-25)11-15-3-8-20(21(12-15)28-2)30-23(27)16-4-6-18(24)7-5-16/h3-12H,1-2H3/b17-11+