ethyl (2E)-2-[(2-bromanyl-5-nitro-phenyl)hydrazinylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-2-[(2-bromanyl-5-nitro-phenyl)hydrazinylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-2-[(2-bromo-5-nitro-phenyl)hydrazono]-3-oxo-butanoate CAS Name: (2E)-2-[(2-bromo-5-nitrophenyl)hydrazinylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(2-bromo-5-nitrophenyl)hydrazinylidene]-3-oxobutanoate Traditional Name: (2E)-2-[(2-bromo-5-nitro-phenyl)hydrazono]-3-keto-butyric acid ethyl ester Formula: C12H12BrN3O5 MolecularWeight: 358.14478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=C(C=CC(=C1)[N+](=O)[O-])Br)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=N/NC1=C(C=CC(=C1)[N+](=O)[O-])Br)/C(=O)C

InChI

InChI=1S/C12H12BrN3O5/c1-3-21-12(18)11(7(2)17)15-14-10-6-8(16(19)20)4-5-9(10)13/h4-6,14H,3H2,1-2H3/b15-11+