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

Systemtic Name: 5-bromanyl-6-nitro-2-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 5-bromo-2-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 5-bromo-2-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 5-bromo-2-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 5-bromo-2-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C12H5BrN2O5 MolecularWeight: 337.0825

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])Br)O

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])Br)O

InChI

InChI=1S/C12H5BrN2O5/c13-8-4-7-9-5(10(8)15(19)20)2-1-3-6(9)11(16)14(18)12(7)17/h1-4,18H