5-bromanyl-6,7-dinitro-2-oxidanyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5-bromanyl-6,7-dinitro-2-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 5-bromo-2-hydroxy-6,7-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 5-bromo-2-hydroxy-6,7-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 5-bromo-2-hydroxy-6,7-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 5-bromo-2-hydroxy-6,7-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C12H4BrN3O7 MolecularWeight: 382.08006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C3=C1C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])Br)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C3=C1C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])Br)O)[N+](=O)[O-]

InChI

InChI=1S/C12H4BrN3O7/c13-6-3-5-8-4(11(17)14(19)12(5)18)1-2-7(15(20)21)9(8)10(6)16(22)23/h1-3,19H