2-(2,6-dimethylphenyl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2,6-dimethylphenyl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2,6-dimethylphenyl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2,6-dimethylphenyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2,6-dimethylphenyl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2,6-dimethylphenyl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H14N2O4 MolecularWeight: 346.33616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C20H14N2O4/c1-11-5-3-6-12(2)18(11)21-19(23)14-8-4-7-13-16(22(25)26)10-9-15(17(13)14)20(21)24/h3-10H,1-2H3