quinolin-8-yl (4E)-3-methyl-4-(pyridin-4-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: quinolin-8-yl (4E)-3-methyl-4-(pyridin-4-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 8-quinolyl (4E)-3-methyl-4-(pyridine-4-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (4E)-3-methyl-4-(pyridine-4-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-(isonicotinoylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolyl ester Formula: C25H20N4O4 MolecularWeight: 440.4507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=NC=C3)CCC2)C(=O)OC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=NC=C3)/CCC2)C(=O)OC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H20N4O4/c1-15-21-18(28-29-24(30)17-10-13-26-14-11-17)7-3-8-19(21)32-23(15)25(31)33-20-9-2-5-16-6-4-12-27-22(16)20/h2,4-6,9-14H,3,7-8H2,1H3,(H,29,30)/b28-18+