[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]-oxidanyl-methyl]phosphonic acid

Systemtic Name: [[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]-oxidanyl-methyl]phosphonic acid Openeye Name: [hydroxy-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]phosphonic acid CAS Name: [hydroxy-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]phosphonic acid IUPAC Name: [hydroxy-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]phosphonic acid Traditional Name: [(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)-hydroxy-methyl]phosphonic acid Formula: C9H8N3O8P MolecularWeight: 317.148881

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC(=O)C(=O)N2)C(O)P(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=C1NC(=O)C(=O)N2)C(O)P(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H8N3O8P/c13-7-8(14)11-6-4(9(15)21(18,19)20)1-3(12(16)17)2-5(6)10-7/h1-2,9,15H,(H,10,13)(H,11,14)(H2,18,19,20)