2-(2-ethanoylphenoxy)ethyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: 2-(2-ethanoylphenoxy)ethyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: 2-(2-acetylphenoxy)ethyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid 2-(2-acetylphenoxy)ethyl ester IUPAC Name: 2-(2-acetylphenoxy)ethyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid 2-(2-acetylphenoxy)ethyl ester Formula: C21H19FO5S MolecularWeight: 402.435963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCOC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCOC(=O)C2=C(C3=C(C=CC=C3S2)F)COC

InChI

InChI=1S/C21H19FO5S/c1-13(23)14-6-3-4-8-17(14)26-10-11-27-21(24)20-15(12-25-2)19-16(22)7-5-9-18(19)28-20/h3-9H,10-12H2,1-2H3