ethyl 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]-1-benzofuran-4-carboxylate

Systemtic Name: ethyl 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]-1-benzofuran-4-carboxylate Openeye Name: ethyl 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]benzofuran-4-carboxylate CAS Name: 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]-4-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]-1-benzofuran-4-carboxylate Traditional Name: 2-[(1E,3E)-4-(4-fluorophenyl)buta-1,3-dienyl]benzofuran-4-carboxylic acid ethyl ester Formula: C21H17FO3 MolecularWeight: 336.356283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(OC2=CC=C1)C=CC=CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C2C=C(OC2=CC=C1)/C=C/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17FO3/c1-2-24-21(23)18-8-5-9-20-19(18)14-17(25-20)7-4-3-6-15-10-12-16(22)13-11-15/h3-14H,2H2,1H3/b6-3+,7-4+