(5-bromanylquinolin-8-yl) (4E)-4-[(4-methoxyphenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: (5-bromanylquinolin-8-yl) (4E)-4-[(4-methoxyphenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: (5-bromo-8-quinolyl) (4E)-4-[(4-methoxybenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[[(4-methoxyphenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid (5-bromo-8-quinolinyl) ester IUPAC Name: (5-bromoquinolin-8-yl) (4E)-4-[(4-methoxybenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(p-anisoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid (5-bromo-8-quinolyl) ester Formula: C27H22BrN3O5 MolecularWeight: 548.38468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)OC)CCC2)C(=O)OC4=C5C(=C(C=C4)Br)C=CC=N5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)OC)/CCC2)C(=O)OC4=C5C(=C(C=C4)Br)C=CC=N5

InChI

InChI=1S/C27H22BrN3O5/c1-15-23-20(30-31-26(32)16-8-10-17(34-2)11-9-16)6-3-7-21(23)35-25(15)27(33)36-22-13-12-19(28)18-5-4-14-29-24(18)22/h4-5,8-14H,3,6-7H2,1-2H3,(H,31,32)/b30-20+