ethyl 5-bromanyl-3-[[3-(1,2,3,4-tetrazol-1-yl)phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[[3-(1,2,3,4-tetrazol-1-yl)phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[[3-(tetrazol-1-yl)benzoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[oxo-[3-(1-tetrazolyl)phenyl]methoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[[3-(tetrazol-1-yl)benzoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[[3-(tetrazol-1-yl)benzoyl]oxymethyl]coumarilic acid ethyl ester Formula: C20H15BrN4O5 MolecularWeight: 471.2609

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC(=CC=C3)N4C=NN=N4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC(=CC=C3)N4C=NN=N4

InChI

InChI=1S/C20H15BrN4O5/c1-2-28-20(27)18-16(15-9-13(21)6-7-17(15)30-18)10-29-19(26)12-4-3-5-14(8-12)25-11-22-23-24-25/h3-9,11H,2,10H2,1H3