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

Systemtic Name: [(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 3-methoxybenzoate Openeye Name: [(2Z)-4-methyl-3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [(2Z)-4-methyl-3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl] ester IUPAC Name: [(2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [(2Z)-3-keto-4-methyl-2-(3-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=CN=CC=C3)O2)OC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

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

InChI

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