(2-methylquinolin-8-yl) (4E)-3-methyl-4-[(4-methylphenyl)sulfonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: (2-methylquinolin-8-yl) (4E)-3-methyl-4-[(4-methylphenyl)sulfonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (2-methyl-8-quinolyl) (4E)-3-methyl-4-(p-tolylsulfonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[(4-methylphenyl)sulfonylhydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) (4E)-3-methyl-4-[(4-methylphenyl)sulfonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(tosylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid (2-methyl-8-quinolyl) ester Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)OC4=CC=CC5=C4N=C(C=C5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)OC4=CC=CC5=C4N=C(C=C5)C)C

InChI

InChI=1S/C27H25N3O5S/c1-16-10-14-20(15-11-16)36(32,33)30-29-21-7-5-8-22-24(21)18(3)26(34-22)27(31)35-23-9-4-6-19-13-12-17(2)28-25(19)23/h4,6,9-15,30H,5,7-8H2,1-3H3/b29-21+