2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(2,5-dimethylphenyl)-5-(3-nitrophenoxy)isoindoline-1,3-quinone Formula: C22H16N2O5 MolecularWeight: 388.37284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

InChI

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