ethyl 6-bromanyl-5-(2-ethoxy-2-oxidanylidene-1-phenyl-ethoxy)-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-(2-ethoxy-2-oxidanylidene-1-phenyl-ethoxy)-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(2-ethoxy-2-oxo-1-phenyl-ethoxy)-2-phenyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-(2-ethoxy-2-oxo-1-phenylethoxy)-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(2-ethoxy-2-oxo-1-phenylethoxy)-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(2-ethoxy-2-keto-1-phenyl-ethoxy)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C27H23BrO6 MolecularWeight: 523.37192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(C3=CC=CC=C3)C(=O)OCC)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(C3=CC=CC=C3)C(=O)OCC)Br)C4=CC=CC=C4

InChI

InChI=1S/C27H23BrO6/c1-3-31-26(29)23-19-15-22(34-25(27(30)32-4-2)18-13-9-6-10-14-18)20(28)16-21(19)33-24(23)17-11-7-5-8-12-17/h5-16,25H,3-4H2,1-2H3