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

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 1-benzofuran-2-carboxylate Openeye Name: (2-bromo-4-phenyl-phenyl) benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (2-bromo-4-phenyl-phenyl) ester Formula: C21H13BrO3 MolecularWeight: 393.23012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC4=CC=CC=C4O3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC4=CC=CC=C4O3)Br

InChI

InChI=1S/C21H13BrO3/c22-17-12-15(14-6-2-1-3-7-14)10-11-19(17)25-21(23)20-13-16-8-4-5-9-18(16)24-20/h1-13H