5-nitro-2-(2-oxidanylidenepropyl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(2-oxidanylidenepropyl)isoindole-1,3-dione Openeye Name: 2-acetonyl-5-nitro-isoindoline-1,3-dione CAS Name: 5-nitro-2-(2-oxopropyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(2-oxopropyl)isoindole-1,3-dione Traditional Name: 2-acetonyl-5-nitro-isoindoline-1,3-quinone Formula: C11H8N2O5 MolecularWeight: 248.19162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H8N2O5/c1-6(14)5-12-10(15)8-3-2-7(13(17)18)4-9(8)11(12)16/h2-4H,5H2,1H3