1-[6-azanyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethylphosphonic acid

Systemtic Name: 1-[6-azanyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]ethylphosphonic acid Openeye Name: 1-(6-amino-2,3-dioxo-4H-quinoxalin-1-yl)ethylphosphonic acid CAS Name: 1-(6-amino-2,3-dioxo-4H-quinoxalin-1-yl)ethylphosphonic acid IUPAC Name: 1-(6-amino-2,3-dioxo-4H-quinoxalin-1-yl)ethylphosphonic acid Traditional Name: 1-(6-amino-2,3-diketo-4H-quinoxalin-1-yl)ethylphosphonic acid Formula: C10H12N3O5P MolecularWeight: 285.193141

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=C(C=C(C=C2)N)NC(=O)C1=O)P(=O)(O)O

Isomeric SMILES

CC(N1C2=C(C=C(C=C2)N)NC(=O)C1=O)P(=O)(O)O

InChI

InChI=1S/C10H12N3O5P/c1-5(19(16,17)18)13-8-3-2-6(11)4-7(8)12-9(14)10(13)15/h2-5H,11H2,1H3,(H,12,14)(H2,16,17,18)