[4-(4-cyanophenyl)phenyl] 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 3-methyl-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid [4-(4-cyanophenyl)phenyl] ester Formula: C23H15NO3 MolecularWeight: 353.3701

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)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H15NO3/c1-15-20-4-2-3-5-21(20)27-22(15)23(25)26-19-12-10-18(11-13-19)17-8-6-16(14-24)7-9-17/h2-13H,1H3