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

Systemtic Name: ethyl (4E)-3-methyl-4-[(3-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: ethyl (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(3-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(m-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)CCCC2=NNC(=O)C3=CC(=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C\2=C(O1)CCC/C2=N\NC(=O)C3=CC(=CC=C3)C)C

InChI

InChI=1S/C20H22N2O4/c1-4-25-20(24)18-13(3)17-15(9-6-10-16(17)26-18)21-22-19(23)14-8-5-7-12(2)11-14/h5,7-8,11H,4,6,9-10H2,1-3H3,(H,22,23)/b21-15+