3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)phenyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)phenyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)phenyl]benzofuran-2-carboxylic acid CAS Name: 3-[4-(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)phenyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[4-(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)phenyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)phenyl]coumarilic acid Formula: C25H21N3O3 MolecularWeight: 411.45254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)C(=O)O)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)C4=C(OC5=CC=CC=C54)C(=O)O)N=C(C=C2C)C

InChI

InChI=1S/C25H21N3O3/c1-4-20-27-22-14(2)13-15(3)26-24(22)28(20)17-11-9-16(10-12-17)21-18-7-5-6-8-19(18)31-23(21)25(29)30/h5-13H,4H2,1-3H3,(H,29,30)