[2-methyl-4-(phenylcarbonyl)phenyl] 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-methyl-4-(phenylcarbonyl)phenyl] 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: (4-benzoyl-2-methyl-phenyl) 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid (4-benzoyl-2-methylphenyl) ester IUPAC Name: (4-benzoyl-2-methylphenyl) 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid (4-benzoyl-2-methyl-phenyl) ester Formula: C23H15BrO4 MolecularWeight: 435.2668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C23H15BrO4/c1-14-11-16(22(25)15-5-3-2-4-6-15)7-9-19(14)28-23(26)21-13-17-12-18(24)8-10-20(17)27-21/h2-13H,1H3