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

Systemtic Name: 5-(2,4-dinitrophenoxy)-2-(4-ethanoylphenyl)isoindole-1,3-dione Openeye Name: 2-(4-acetylphenyl)-5-(2,4-dinitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(4-acetylphenyl)-5-(2,4-dinitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(4-acetylphenyl)-5-(2,4-dinitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(4-acetylphenyl)-5-(2,4-dinitrophenoxy)isoindoline-1,3-quinone Formula: C22H13N3O8 MolecularWeight: 447.35392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H13N3O8/c1-12(26)13-2-4-14(5-3-13)23-21(27)17-8-7-16(11-18(17)22(23)28)33-20-9-6-15(24(29)30)10-19(20)25(31)32/h2-11H,1H3