ethyl (4E)-2-methyl-5-oxidanylidene-4-[(pyridin-2-ylamino)methylidene]benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl (4E)-2-methyl-5-oxidanylidene-4-[(pyridin-2-ylamino)methylidene]benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl (4E)-2-methyl-5-oxo-4-[(2-pyridylamino)methylene]benzo[g]benzofuran-3-carboxylate CAS Name: (4E)-2-methyl-5-oxo-4-[(2-pyridinylamino)methylidene]-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-2-methyl-5-oxo-4-[(pyridin-2-ylamino)methylidene]benzo[g][1]benzofuran-3-carboxylate Traditional Name: (4E)-5-keto-2-methyl-4-[(2-pyridylamino)methylene]benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=CNC3=CC=CC=N3)C(=O)C4=CC=CC=C42)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1/C(=C\NC3=CC=CC=N3)/C(=O)C4=CC=CC=C42)C

InChI

InChI=1S/C22H18N2O4/c1-3-27-22(26)18-13(2)28-21-15-9-5-4-8-14(15)20(25)16(19(18)21)12-24-17-10-6-7-11-23-17/h4-12H,3H2,1-2H3,(H,23,24)/b16-12+