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

Systemtic Name: quinolin-8-yl (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 8-quinolyl (4E)-3-methyl-4-(phenylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(phenylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid 8-quinolyl ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=CC=CC=C3)CCC2)C(=O)OC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=CC=CC=C3)/CCC2)C(=O)OC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H21N3O3/c1-16-22-19(28-27-18-10-3-2-4-11-18)12-6-13-20(22)30-24(16)25(29)31-21-14-5-8-17-9-7-15-26-23(17)21/h2-5,7-11,14-15,27H,6,12-13H2,1H3/b28-19+