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

Systemtic Name: [7-(2-methoxyethylamino)-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]methylphosphonic acid Openeye Name: [7-(2-methoxyethylamino)-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl]methylphosphonic acid CAS Name: [7-(2-methoxyethylamino)-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl]methylphosphonic acid IUPAC Name: [7-(2-methoxyethylamino)-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl]methylphosphonic acid Traditional Name: [2,3-diketo-7-(2-methoxyethylamino)-6-nitro-4H-quinoxalin-1-yl]methylphosphonic acid Formula: C12H15N4O8P MolecularWeight: 374.243261

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C2C(=C1)N(C(=O)C(=O)N2)CP(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C2C(=C1)N(C(=O)C(=O)N2)CP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H15N4O8P/c1-24-3-2-13-7-4-9-8(5-10(7)16(19)20)14-11(17)12(18)15(9)6-25(21,22)23/h4-5,13H,2-3,6H2,1H3,(H,14,17)(H2,21,22,23)