2-(4-ethanoylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(4-ethanoylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(4-acetylphenyl)-5-(3-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(4-acetylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(4-acetylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(4-acetylphenyl)-5-(3-nitrophenoxy)isoindoline-1,3-quinone Formula: C22H14N2O6 MolecularWeight: 402.35636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O6/c1-13(25)14-5-7-15(8-6-14)23-21(26)19-10-9-18(12-20(19)22(23)27)30-17-4-2-3-16(11-17)24(28)29/h2-12H,1H3