(4-bromanyl-3-methyl-phenyl) 1-benzofuran-2-carboxylate

Systemtic Name: (4-bromanyl-3-methyl-phenyl) 1-benzofuran-2-carboxylate Openeye Name: (4-bromo-3-methyl-phenyl) benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid (4-bromo-3-methylphenyl) ester IUPAC Name: (4-bromo-3-methylphenyl) 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid (4-bromo-3-methyl-phenyl) ester Formula: C16H11BrO3 MolecularWeight: 331.16074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=CC3=CC=CC=C3O2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=CC3=CC=CC=C3O2)Br

InChI

InChI=1S/C16H11BrO3/c1-10-8-12(6-7-13(10)17)19-16(18)15-9-11-4-2-3-5-14(11)20-15/h2-9H,1H3