2-acetyloxy-5-bromanyl-3-nitro-benzoic acid

Systemtic Name: 2-acetyloxy-5-bromanyl-3-nitro-benzoic acid Openeye Name: 2-acetoxy-5-bromo-3-nitro-benzoic acid CAS Name: 2-acetyloxy-5-bromo-3-nitrobenzoic acid IUPAC Name: 2-acetyloxy-5-bromo-3-nitrobenzoic acid Traditional Name: 2-acetoxy-5-bromo-3-nitro-benzoic acid Formula: C9H6BrNO6 MolecularWeight: 304.05104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(=O)O)Br)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(=O)O)Br)[N+](=O)[O-]

InChI

InChI=1S/C9H6BrNO6/c1-4(12)17-8-6(9(13)14)2-5(10)3-7(8)11(15)16/h2-3H,1H3,(H,13,14)