[2-bromanyl-1-(4-nitrophenyl)ethyl] nitrate

Systemtic Name: [2-bromanyl-1-(4-nitrophenyl)ethyl] nitrate Openeye Name: [2-bromo-1-(4-nitrophenyl)ethyl] nitrate CAS Name: nitric acid [2-bromo-1-(4-nitrophenyl)ethyl] ester IUPAC Name: [2-bromo-1-(4-nitrophenyl)ethyl] nitrate Traditional Name: nitric acid [2-bromo-1-(4-nitrophenyl)ethyl] ester Formula: C8H7BrN2O5 MolecularWeight: 291.05558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CBr)O[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CBr)O[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H7BrN2O5/c9-5-8(16-11(14)15)6-1-3-7(4-2-6)10(12)13/h1-4,8H,5H2