ethyl 5-bromanyl-3-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[2-(4-oxidanylidenequinazolin-3-yl)ethanoyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[[2-(4-oxoquinazolin-3-yl)acetyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[[2-(4-oxoquinazolin-3-yl)acetyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[[2-(4-ketoquinazolin-3-yl)acetyl]oxymethyl]coumarilic acid ethyl ester Formula: C22H17BrN2O6 MolecularWeight: 485.28418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17BrN2O6/c1-2-29-22(28)20-16(15-9-13(23)7-8-18(15)31-20)11-30-19(26)10-25-12-24-17-6-4-3-5-14(17)21(25)27/h3-9,12H,2,10-11H2,1H3