[(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 3-methoxybenzoate

Systemtic Name: [(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 3-methoxybenzoate Openeye Name: [(2Z)-4-methyl-3-oxo-2-(4-pyridylmethylene)benzofuran-6-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [(2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-6-benzofuranyl] ester IUPAC Name: [(2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [(2Z)-3-keto-4-methyl-2-(4-pyridylmethylene)coumaran-6-yl] ester Formula: C23H17NO5 MolecularWeight: 387.38478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(=CC3=CC=NC=C3)O2)OC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)/C(=C/C3=CC=NC=C3)/O2)OC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H17NO5/c1-14-10-18(28-23(26)16-4-3-5-17(12-16)27-2)13-19-21(14)22(25)20(29-19)11-15-6-8-24-9-7-15/h3-13H,1-2H3/b20-11-