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

Systemtic Name: ethyl 6-bromanyl-5-(2-ethoxy-2-oxidanylidene-1-phenyl-ethoxy)-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(2-ethoxy-2-oxo-1-phenyl-ethoxy)-2-methyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-(2-ethoxy-2-oxo-1-phenylethoxy)-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(2-ethoxy-2-oxo-1-phenylethoxy)-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(2-ethoxy-2-keto-1-phenyl-ethoxy)-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C22H21BrO6 MolecularWeight: 461.30254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrO6/c1-4-26-21(24)19-13(3)28-17-12-16(23)18(11-15(17)19)29-20(22(25)27-5-2)14-9-7-6-8-10-14/h6-12,20H,4-5H2,1-3H3