[2-nitro-1-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethyl] ethanoate

Systemtic Name: [2-nitro-1-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethyl] ethanoate Openeye Name: [2-nitro-1-(1-oxido-4-oxo-quinoxalin-4-ium-2-yl)ethyl] acetate CAS Name: acetic acid [2-nitro-1-(1-oxido-4-oxo-2-quinoxalin-4-iumyl)ethyl] ester IUPAC Name: [2-nitro-1-(1-oxido-4-oxoquinoxalin-4-ium-2-yl)ethyl] acetate Traditional Name: acetic acid [1-(4-keto-1-oxido-quinoxalin-4-ium-2-yl)-2-nitro-ethyl] ester Formula: C12H11N3O6 MolecularWeight: 293.23224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C[N+](=O)[O-])C1=C[N+](=O)C2=CC=CC=C2N1[O-]

Isomeric SMILES

CC(=O)OC(C[N+](=O)[O-])C1=C[N+](=O)C2=CC=CC=C2N1[O-]

InChI

InChI=1S/C12H11N3O6/c1-8(16)21-12(7-14(18)19)11-6-13(17)9-4-2-3-5-10(9)15(11)20/h2-6,12H,7H2,1H3