2-(4-bromophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-bromophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-bromophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-bromophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-bromophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-bromophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C18H8BrN3O6 MolecularWeight: 442.17662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)Br

InChI

InChI=1S/C18H8BrN3O6/c19-9-1-3-10(4-2-9)20-17(23)11-5-7-13(21(25)26)16-14(22(27)28)8-6-12(15(11)16)18(20)24/h1-8H