5-methyl-6-nitro-isoindole-1,3-dione

Systemtic Name: 5-methyl-6-nitro-isoindole-1,3-dione Openeye Name: 5-methyl-6-nitro-isoindoline-1,3-dione CAS Name: 5-methyl-6-nitroisoindole-1,3-dione IUPAC Name: 5-methyl-6-nitroisoindole-1,3-dione Traditional Name: 5-methyl-6-nitro-isoindoline-1,3-quinone Formula: C9H6N2O4 MolecularWeight: 206.15494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C9H6N2O4/c1-4-2-5-6(3-7(4)11(14)15)9(13)10-8(5)12/h2-3H,1H3,(H,10,12,13)