ethyl 4-fluoranyl-3-(3-phenoxypropanoyloxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-(3-phenoxypropanoyloxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-(3-phenoxypropanoyloxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[(1-oxo-3-phenoxypropoxy)methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-(3-phenoxypropanoyloxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(3-phenoxypropanoyloxymethyl)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)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)CCOC3=CC=CC=C3

InChI

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