[2-nitro-3-(4-nitrophenyl)but-3-enyl] ethanoate

Systemtic Name: [2-nitro-3-(4-nitrophenyl)but-3-enyl] ethanoate Openeye Name: [2-nitro-3-(4-nitrophenyl)but-3-enyl] acetate CAS Name: acetic acid [2-nitro-3-(4-nitrophenyl)but-3-enyl] ester IUPAC Name: [2-nitro-3-(4-nitrophenyl)but-3-enyl] acetate Traditional Name: acetic acid [2-nitro-3-(4-nitrophenyl)but-3-enyl] ester Formula: C12H12N2O6 MolecularWeight: 280.23348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6/c1-8(12(14(18)19)7-20-9(2)15)10-3-5-11(6-4-10)13(16)17/h3-6,12H,1,7H2,2H3