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

Systemtic Name: 2-methyl-5-nitro-6-oxidanyl-isoindole-1,3-dione Openeye Name: 5-hydroxy-2-methyl-6-nitro-isoindoline-1,3-dione CAS Name: 5-hydroxy-2-methyl-6-nitroisoindole-1,3-dione IUPAC Name: 5-hydroxy-2-methyl-6-nitroisoindole-1,3-dione Traditional Name: 5-hydroxy-2-methyl-6-nitro-isoindoline-1,3-quinone Formula: C9H6N2O5 MolecularWeight: 222.15434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC(=C(C=C2C1=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC(=C(C=C2C1=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H6N2O5/c1-10-8(13)4-2-6(11(15)16)7(12)3-5(4)9(10)14/h2-3,12H,1H3