(4-iodophenyl) 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-iodophenyl) 3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-iodophenyl) 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid (4-iodophenyl) ester Formula: C16H11IO3 MolecularWeight: 378.16121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OC3=CC=C(C=C3)I

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OC3=CC=C(C=C3)I

InChI

InChI=1S/C16H11IO3/c1-10-13-4-2-3-5-14(13)20-15(10)16(18)19-12-8-6-11(17)7-9-12/h2-9H,1H3