2-[3-(3,4-dimethylphenyl)carbonylphenyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[3-(3,4-dimethylphenyl)carbonylphenyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[3-(3,4-dimethylbenzoyl)phenyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[3-[(3,4-dimethylphenyl)-oxomethyl]phenyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[3-(3,4-dimethylbenzoyl)phenyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[3-(3,4-dimethylbenzoyl)phenyl]-5-nitro-isoindoline-1,3-quinone Formula: C23H16N2O5 MolecularWeight: 400.38354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H16N2O5/c1-13-6-7-16(10-14(13)2)21(26)15-4-3-5-17(11-15)24-22(27)19-9-8-18(25(29)30)12-20(19)23(24)28/h3-12H,1-2H3