2-(4-methyl-2-nitro-phenyl)-5-(4-methylphenoxy)isoindole-1,3-dione

Systemtic Name: 2-(4-methyl-2-nitro-phenyl)-5-(4-methylphenoxy)isoindole-1,3-dione Openeye Name: 2-(4-methyl-2-nitro-phenyl)-5-(4-methylphenoxy)isoindoline-1,3-dione CAS Name: 2-(4-methyl-2-nitrophenyl)-5-(4-methylphenoxy)isoindole-1,3-dione IUPAC Name: 2-(4-methyl-2-nitrophenyl)-5-(4-methylphenoxy)isoindole-1,3-dione Traditional Name: 2-(4-methyl-2-nitro-phenyl)-5-(4-methylphenoxy)isoindoline-1,3-quinone Formula: C22H16N2O5 MolecularWeight: 388.37284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H16N2O5/c1-13-3-6-15(7-4-13)29-16-8-9-17-18(12-16)22(26)23(21(17)25)19-10-5-14(2)11-20(19)24(27)28/h3-12H,1-2H3