(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 1-benzofuran-2-carboxylate

Systemtic Name: (2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl 1-benzofuran-2-carboxylate Openeye Name: (2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl ester IUPAC Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl ester Formula: C21H15FO5S MolecularWeight: 398.404203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H15FO5S/c1-2-25-21(24)19-13(18-14(22)7-5-9-17(18)28-19)11-26-20(23)16-10-12-6-3-4-8-15(12)27-16/h3-10H,2,11H2,1H3