ethyl 6-bromanyl-5-(1-methoxy-1-oxidanylidene-propan-2-yl)oxy-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-(1-methoxy-1-oxidanylidene-propan-2-yl)oxy-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(2-methoxy-1-methyl-2-oxo-ethoxy)-2-phenyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-(1-methoxy-1-oxopropan-2-yl)oxy-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(1-methoxy-1-oxopropan-2-yl)oxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(2-keto-2-methoxy-1-methyl-ethoxy)-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H19BrO6 MolecularWeight: 447.27596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrO6/c1-4-26-21(24)18-14-10-17(27-12(2)20(23)25-3)15(22)11-16(14)28-19(18)13-8-6-5-7-9-13/h5-12H,4H2,1-3H3