5-(3,4-dimethylphenoxy)-2-(3-nitrophenyl)isoindole-1,3-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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