4-azanyl-7-nitro-isoindole-1,3-dione

Systemtic Name: 4-azanyl-7-nitro-isoindole-1,3-dione Openeye Name: 4-amino-7-nitro-isoindoline-1,3-dione CAS Name: 4-amino-7-nitroisoindole-1,3-dione IUPAC Name: 4-amino-7-nitroisoindole-1,3-dione Traditional Name: 4-amino-7-nitro-isoindoline-1,3-quinone Formula: C8H5N3O4 MolecularWeight: 207.143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1N)C(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1N)C(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C8H5N3O4/c9-3-1-2-4(11(14)15)6-5(3)7(12)10-8(6)13/h1-2H,9H2,(H,10,12,13)