pyridin-3-yl (4E)-3-methyl-4-[(2-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: pyridin-3-yl (4E)-3-methyl-4-[(2-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 3-pyridyl (4E)-3-methyl-4-[(2-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(2-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl (4E)-3-methyl-4-[(2-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(o-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridyl ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)OC4=CN=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)OC4=CN=CC=C4)C

InChI

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