O4-[(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl] ester O1-methyl ester Formula: C21H17FO6S MolecularWeight: 416.419483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17FO6S/c1-3-27-21(25)18-14(17-15(22)5-4-6-16(17)29-18)11-28-20(24)13-9-7-12(8-10-13)19(23)26-2/h4-10H,3,11H2,1-2H3