ethyl 4-fluoranyl-3-[2-(3-methylphenoxy)ethanoyloxymethyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[2-(3-methylphenoxy)ethanoyloxymethyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[2-(3-methylphenoxy)acetyl]oxymethyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[2-(3-methylphenoxy)-1-oxoethoxy]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[2-(3-methylphenoxy)acetyl]oxymethyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[2-(3-methylphenoxy)acetyl]oxymethyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C21H19FO5S MolecularWeight: 402.435963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)COC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)COC3=CC=CC(=C3)C

InChI

InChI=1S/C21H19FO5S/c1-3-25-21(24)20-15(19-16(22)8-5-9-17(19)28-20)11-27-18(23)12-26-14-7-4-6-13(2)10-14/h4-10H,3,11-12H2,1-2H3