[7-bromanyl-6-nitro-2,3-bis(oxidanylidene)-4H-benzo[h]quinoxalin-1-yl]methylphosphonic acid

Systemtic Name: [7-bromanyl-6-nitro-2,3-bis(oxidanylidene)-4H-benzo[h]quinoxalin-1-yl]methylphosphonic acid Openeye Name: (7-bromo-6-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid CAS Name: (7-bromo-6-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid IUPAC Name: (7-bromo-6-nitro-2,3-dioxo-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid Traditional Name: (7-bromo-2,3-diketo-6-nitro-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid Formula: C13H9BrN3O7P MolecularWeight: 430.104221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=CC(=C2C(=C1)Br)[N+](=O)[O-])NC(=O)C(=O)N3CP(=O)(O)O

Isomeric SMILES

C1=CC2=C3C(=CC(=C2C(=C1)Br)[N+](=O)[O-])NC(=O)C(=O)N3CP(=O)(O)O

InChI

InChI=1S/C13H9BrN3O7P/c14-7-3-1-2-6-10(7)9(17(20)21)4-8-11(6)16(5-25(22,23)24)13(19)12(18)15-8/h1-4H,5H2,(H,15,18)(H2,22,23,24)