(6-azanyl-4-morpholin-4-yl-2-pentyl-pyrimidin-1-ium-1-yl) hydrogen sulfate

Systemtic Name: (6-azanyl-4-morpholin-4-yl-2-pentyl-pyrimidin-1-ium-1-yl) hydrogen sulfate Openeye Name: (6-amino-4-morpholino-2-pentyl-pyrimidin-1-ium-1-yl) hydrogen sulfate CAS Name: sulfuric acid [6-amino-4-(4-morpholinyl)-2-pentyl-1-pyrimidin-1-iumyl] ester IUPAC Name: (6-amino-4-morpholin-4-yl-2-pentylpyrimidin-1-ium-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (6-amino-2-amyl-4-morpholino-pyrimidin-1-ium-1-yl) ester Formula: C13H23N4O5S+ MolecularWeight: 347.41052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC(=CC(=[N+]1OS(=O)(=O)O)N)N2CCOCC2

Isomeric SMILES

CCCCCC1=NC(=CC(=[N+]1OS(=O)(=O)O)N)N2CCOCC2

InChI

InChI=1S/C13H22N4O5S/c1-2-3-4-5-12-15-13(16-6-8-21-9-7-16)10-11(14)17(12)22-23(18,19)20/h10,14H,2-9H2,1H3,(H,18,19,20)/p+1