2-(3-ethanoylphenyl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(3-ethanoylphenyl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(3-acetylphenyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(3-acetylphenyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(3-acetylphenyl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(3-acetylphenyl)-4-nitro-isoindoline-1,3-quinone Formula: C16H10N2O5 MolecularWeight: 310.261

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O5/c1-9(19)10-4-2-5-11(8-10)17-15(20)12-6-3-7-13(18(22)23)14(12)16(17)21/h2-8H,1H3