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

Systemtic Name: (4-methylphenyl) (4E)-3-methyl-4-(pyridin-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: p-tolyl (4E)-3-methyl-4-(pyridine-2-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[oxo(2-pyridinyl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) (4E)-3-methyl-4-(pyridine-2-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(picolinoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid p-tolyl ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=C(C3=C(O2)CCCC3=NNC(=O)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=C(C\3=C(O2)CCC/C3=N\NC(=O)C4=CC=CC=N4)C

InChI

InChI=1S/C23H21N3O4/c1-14-9-11-16(12-10-14)29-23(28)21-15(2)20-17(7-5-8-19(20)30-21)25-26-22(27)18-6-3-4-13-24-18/h3-4,6,9-13H,5,7-8H2,1-2H3,(H,26,27)/b25-17+