[2-azanyl-8-(hydroxymethyl)-3-methyl-imidazo[4,5-f]quinoxalin-5-yl] hydrogen sulfate

Systemtic Name: [2-azanyl-8-(hydroxymethyl)-3-methyl-imidazo[4,5-f]quinoxalin-5-yl] hydrogen sulfate Openeye Name: [2-amino-8-(hydroxymethyl)-3-methyl-imidazo[4,5-f]quinoxalin-5-yl] hydrogen sulfate CAS Name: sulfuric acid [2-amino-8-(hydroxymethyl)-3-methyl-5-imidazo[4,5-f]quinoxalinyl] ester IUPAC Name: [2-amino-8-(hydroxymethyl)-3-methylimidazo[4,5-f]quinoxalin-5-yl] hydrogen sulfate Traditional Name: sulfuric acid (2-amino-3-methyl-8-methylol-imidazo[4,5-f]quinoxalin-5-yl) ester Formula: C11H11N5O5S MolecularWeight: 325.30054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C3C(=C2N=C1N)N=C(C=N3)CO)OS(=O)(=O)O

Isomeric SMILES

CN1C2=CC(=C3C(=C2N=C1N)N=C(C=N3)CO)OS(=O)(=O)O

InChI

InChI=1S/C11H11N5O5S/c1-16-6-2-7(21-22(18,19)20)9-10(8(6)15-11(16)12)14-5(4-17)3-13-9/h2-3,17H,4H2,1H3,(H2,12,15)(H,18,19,20)