N-(5-bromanyl-3-nitro-6-oxidanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)ethanamide

Systemtic Name: N-(5-bromanyl-3-nitro-6-oxidanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl)ethanamide Openeye Name: N-(5-bromo-6-hydroxy-3-nitro-7-oxo-cyclohepta-1,3,5-trien-1-yl)acetamide CAS Name: N-(5-bromo-6-hydroxy-3-nitro-7-oxo-1-cyclohepta-1,3,5-trienyl)acetamide IUPAC Name: N-(5-bromo-6-hydroxy-3-nitro-7-oxocyclohepta-1,3,5-trien-1-yl)acetamide Traditional Name: N-(5-bromo-6-hydroxy-7-keto-3-nitro-cyclohepta-1,3,5-trien-1-yl)acetamide Formula: C9H7BrN2O5 MolecularWeight: 303.06628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7BrN2O5/c1-4(13)11-7-3-5(12(16)17)2-6(10)8(14)9(7)15/h2-3H,1H3,(H2,11,13,14,15)