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

Systemtic Name: propyl (4E)-4-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: propyl (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[[(5-bromo-3-pyridinyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid propyl ester IUPAC Name: propyl (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(5-bromonicotinoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid propyl ester Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C2=C(O1)CCCC2=NNC(=O)C3=CC(=CN=C3)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O4/c1-3-7-26-19(25)17-11(2)16-14(5-4-6-15(16)27-17)22-23-18(24)12-8-13(20)10-21-9-12/h8-10H,3-7H2,1-2H3,(H,23,24)/b22-14+