(4-cyanophenyl) 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-cyanophenyl) 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-cyanophenyl) 5-ethoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-ethoxy-3-methyl-2-benzofurancarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-ethoxy-3-methyl-coumarilic acid (4-cyanophenyl) ester Formula: C19H15NO4 MolecularWeight: 321.3267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15NO4/c1-3-22-15-8-9-17-16(10-15)12(2)18(24-17)19(21)23-14-6-4-13(11-20)5-7-14/h4-10H,3H2,1-2H3