ethyl 6-(3-fluorophenyl)-3-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 6-(3-fluorophenyl)-3-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: ethyl 6-(3-fluorophenyl)-3-methyl-4-oxo-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: 6-(3-fluorophenyl)-3-methyl-4-oxo-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-fluorophenyl)-3-methyl-4-oxo-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: 6-(3-fluorophenyl)-4-keto-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester Formula: C18H17FO4 MolecularWeight: 316.323583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)CC(CC2=O)C3=CC(=CC=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)CC(CC2=O)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C18H17FO4/c1-3-22-18(21)17-10(2)16-14(20)8-12(9-15(16)23-17)11-5-4-6-13(19)7-11/h4-7,12H,3,8-9H2,1-2H3