3-azanyl-6,7-dinitro-isoindol-1-one

Systemtic Name: 3-azanyl-6,7-dinitro-isoindol-1-one Openeye Name: 3-amino-6,7-dinitro-isoindol-1-one CAS Name: 3-amino-6,7-dinitro-1-isoindolone IUPAC Name: 3-amino-6,7-dinitroisoindol-1-one Traditional Name: 3-amino-6,7-dinitro-isoindol-1-one Formula: C8H4N4O5 MolecularWeight: 236.14116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1C(=NC2=O)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C2=C1C(=NC2=O)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H4N4O5/c9-7-3-1-2-4(11(14)15)6(12(16)17)5(3)8(13)10-7/h1-2H,(H2,9,10,13)