[2,4-bis(azanyl)-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl] hydrogen sulfate

Systemtic Name: [2,4-bis(azanyl)-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl] hydrogen sulfate Openeye Name: (2,4-diamino-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl) hydrogen sulfate CAS Name: sulfuric acid (2,4-diamino-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl) ester IUPAC Name: (2,4-diamino-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl) hydrogen sulfate Traditional Name: sulfuric acid (2,4-diamino-6-hexoxy-1,2-dihydropyrimidin-3-ium-3-yl) ester Formula: C10H21N4O5S+ MolecularWeight: 309.36254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=[N+](C(N1)N)OS(=O)(=O)O)N

Isomeric SMILES

CCCCCCOC1=CC(=[N+](C(N1)N)OS(=O)(=O)O)N

InChI

InChI=1S/C10H20N4O5S/c1-2-3-4-5-6-18-9-7-8(11)14(10(12)13-9)19-20(15,16)17/h7,10H,2-6,12H2,1H3,(H3,11,13,15,16,17)/p+1