(5-methyl-2-oxidanylidene-oxolan-3-yl) 4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: (5-methyl-2-oxidanylidene-oxolan-3-yl) 4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: (5-methyl-2-oxo-tetrahydrofuran-3-yl) 4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxylic acid (5-methyl-2-oxo-3-oxolanyl) ester IUPAC Name: (5-methyl-2-oxooxolan-3-yl) 4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxylic acid (2-keto-5-methyl-tetrahydrofuran-3-yl) ester Formula: C21H17FO5S MolecularWeight: 400.420083

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)OC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

Isomeric SMILES

CC1CC(C(=O)O1)OC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

InChI

InChI=1S/C21H17FO5S/c1-12-10-16(20(23)26-12)27-21(24)19-14(11-25-13-6-3-2-4-7-13)18-15(22)8-5-9-17(18)28-19/h2-9,12,16H,10-11H2,1H3