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

Systemtic Name: [4-[2-cyano-3-(2-methoxyethoxy)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[2-cyano-3-(2-methoxyethoxy)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[2-cyano-3-keto-3-(2-methoxyethoxy)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H18FNO6 MolecularWeight: 399.369123

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)F)OC)C#N

Isomeric SMILES

COCCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)F)OC)C#N

InChI

InChI=1S/C21H18FNO6/c1-26-9-10-28-20(24)16(13-23)11-14-3-8-18(19(12-14)27-2)29-21(25)15-4-6-17(22)7-5-15/h3-8,11-12H,9-10H2,1-2H3