(2-bromanyl-4-phenyl-phenyl) 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: (2-bromo-4-phenyl-phenyl) 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid (2-bromo-4-phenyl-phenyl) ester Formula: C21H12Br2O3 MolecularWeight: 472.12618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br)Br

InChI

InChI=1S/C21H12Br2O3/c22-16-7-9-18-15(10-16)12-20(25-18)21(24)26-19-8-6-14(11-17(19)23)13-4-2-1-3-5-13/h1-12H