ethyl (3E)-3-[(3-bromanyl-4-methyl-phenyl)carbonylhydrazinylidene]-2-ethyl-butanoate

Systemtic Name: ethyl (3E)-3-[(3-bromanyl-4-methyl-phenyl)carbonylhydrazinylidene]-2-ethyl-butanoate Openeye Name: ethyl (3E)-3-[(3-bromo-4-methyl-benzoyl)hydrazono]-2-ethyl-butanoate CAS Name: (3E)-3-[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazinylidene]-2-ethylbutanoic acid ethyl ester IUPAC Name: ethyl (3E)-3-[(3-bromo-4-methylbenzoyl)hydrazinylidene]-2-ethylbutanoate Traditional Name: (3E)-3-[(3-bromo-4-methyl-benzoyl)hydrazono]-2-ethyl-butyric acid ethyl ester Formula: C16H21BrN2O3 MolecularWeight: 369.25354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=NNC(=O)C1=CC(=C(C=C1)C)Br)C)C(=O)OCC

Isomeric SMILES

CCC(/C(=N/NC(=O)C1=CC(=C(C=C1)C)Br)/C)C(=O)OCC

InChI

InChI=1S/C16H21BrN2O3/c1-5-13(16(21)22-6-2)11(4)18-19-15(20)12-8-7-10(3)14(17)9-12/h7-9,13H,5-6H2,1-4H3,(H,19,20)/b18-11+