2-bromanyl-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium

Systemtic Name: 2-bromanyl-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium Openeye Name: 2-bromo-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium CAS Name: 2-bromo-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium IUPAC Name: 2-bromo-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium Traditional Name: 2-bromo-1-(2-nitrophenyl)ethanone; 1H-imidazol-1-ium Formula: C11H11BrN3O3+ MolecularWeight: 313.12734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-].C1=CN=C[NH2+]1

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-].C1=CN=C[NH2+]1

InChI

InChI=1S/C8H6BrNO3.C3H4N2/c9-5-8(11)6-3-1-2-4-7(6)10(12)13;1-2-5-3-4-1/h1-4H,5H2;1-3H,(H,4,5)/p+1