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

Systemtic Name: ethyl 6-bromanyl-2-tert-butyl-5-(2-ethoxy-2-oxidanylidene-1-phenyl-ethoxy)-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenyl-ethoxy)benzofuran-3-carboxylate CAS Name: 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-tert-butyl-5-(2-ethoxy-2-keto-1-phenyl-ethoxy)benzofuran-3-carboxylic acid ethyl ester Formula: C25H27BrO6 MolecularWeight: 503.38228

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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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H27BrO6/c1-6-29-23(27)20-16-13-19(17(26)14-18(16)32-22(20)25(3,4)5)31-21(24(28)30-7-2)15-11-9-8-10-12-15/h8-14,21H,6-7H2,1-5H3