ethyl 5-(hydroxymethyl)-7-methoxy-2-[4-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-(hydroxymethyl)-7-methoxy-2-[4-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-(hydroxymethyl)-7-methoxy-2-[4-(trifluoromethyl)phenyl]benzofuran-3-carboxylate CAS Name: 5-(hydroxymethyl)-7-methoxy-2-[4-(trifluoromethyl)phenyl]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(hydroxymethyl)-7-methoxy-2-[4-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxylate Traditional Name: 7-methoxy-5-methylol-2-[4-(trifluoromethyl)phenyl]benzofuran-3-carboxylic acid ethyl ester Formula: C20H17F3O5 MolecularWeight: 394.34119

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C=C(C=C12)CO)OC)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C=C(C=C12)CO)OC)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H17F3O5/c1-3-27-19(25)16-14-8-11(10-24)9-15(26-2)18(14)28-17(16)12-4-6-13(7-5-12)20(21,22)23/h4-9,24H,3,10H2,1-2H3