5-nitro-2-[3-(phenylcarbonyl)phenyl]isoindole-1,3-dione

Systemtic Name: 5-nitro-2-[3-(phenylcarbonyl)phenyl]isoindole-1,3-dione Openeye Name: 2-(3-benzoylphenyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(3-benzoylphenyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(3-benzoylphenyl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(3-benzoylphenyl)-5-nitro-isoindoline-1,3-quinone Formula: C21H12N2O5 MolecularWeight: 372.33038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H12N2O5/c24-19(13-5-2-1-3-6-13)14-7-4-8-15(11-14)22-20(25)17-10-9-16(23(27)28)12-18(17)21(22)26/h1-12H