(2-azanyl-4-morpholin-4-yl-6-propan-2-yl-pyridin-1-ium-1-yl) hydrogen sulfate

Systemtic Name: (2-azanyl-4-morpholin-4-yl-6-propan-2-yl-pyridin-1-ium-1-yl) hydrogen sulfate Openeye Name: (2-amino-6-isopropyl-4-morpholino-pyridin-1-ium-1-yl) hydrogen sulfate CAS Name: sulfuric acid [2-amino-4-(4-morpholinyl)-6-propan-2-yl-1-pyridin-1-iumyl] ester IUPAC Name: (2-amino-4-morpholin-4-yl-6-propan-2-ylpyridin-1-ium-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (2-amino-6-isopropyl-4-morpholino-pyridin-1-ium-1-yl) ester Formula: C12H20N3O5S+ MolecularWeight: 318.3693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C(=CC(=C1)N2CCOCC2)N)OS(=O)(=O)O

Isomeric SMILES

CC(C)C1=[N+](C(=CC(=C1)N2CCOCC2)N)OS(=O)(=O)O

InChI

InChI=1S/C12H19N3O5S/c1-9(2)11-7-10(14-3-5-19-6-4-14)8-12(13)15(11)20-21(16,17)18/h7-9,13H,3-6H2,1-2H3,(H,16,17,18)/p+1