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

Systemtic Name: ethyl (4E)-3-methyl-4-(quinolin-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: ethyl (4E)-3-methyl-4-(quinoline-2-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[oxo(2-quinolinyl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl (4E)-3-methyl-4-(quinoline-2-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(quinaldoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)CCCC2=NNC(=O)C3=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C\2=C(O1)CCC/C2=N\NC(=O)C3=NC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C22H21N3O4/c1-3-28-22(27)20-13(2)19-16(9-6-10-18(19)29-20)24-25-21(26)17-12-11-14-7-4-5-8-15(14)23-17/h4-5,7-8,11-12H,3,6,9-10H2,1-2H3,(H,25,26)/b24-16+