ethyl 3-[[2,4-bis(fluoranyl)phenyl]carbonyloxymethyl]-4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[2,4-bis(fluoranyl)phenyl]carbonyloxymethyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(2,4-difluorobenzoyl)oxymethyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[[(2,4-difluorophenyl)-oxomethoxy]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-difluorobenzoyl)oxymethyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[(2,4-difluorobenzoyl)oxymethyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C19H13F3O4S MolecularWeight: 394.36433

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13F3O4S/c1-2-25-19(24)17-12(16-13(21)4-3-5-15(16)27-17)9-26-18(23)11-7-6-10(20)8-14(11)22/h3-8H,2,9H2,1H3