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

Systemtic Name: [(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] furan-2-carboxylate Openeye Name: [(2Z)-4-methyl-3-oxo-2-(4-pyridylmethylene)benzofuran-6-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic 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] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(2Z)-3-keto-4-methyl-2-(4-pyridylmethylene)coumaran-6-yl] ester Formula: C20H13NO5 MolecularWeight: 347.32092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(=CC3=CC=NC=C3)O2)OC(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)/C(=C/C3=CC=NC=C3)/O2)OC(=O)C4=CC=CO4

InChI

InChI=1S/C20H13NO5/c1-12-9-14(25-20(23)15-3-2-8-24-15)11-16-18(12)19(22)17(26-16)10-13-4-6-21-7-5-13/h2-11H,1H3/b17-10-