(2-azanyl-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) hydrogen sulfate hydroxide

Systemtic Name: (2-azanyl-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) hydrogen sulfate hydroxide Openeye Name: (2-amino-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) hydrogen sulfate hydroxide CAS Name: sulfuric acid (2-amino-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) ester hydroxide IUPAC Name: (2-amino-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) hydrogen sulfate hydroxide Traditional Name: sulfuric acid (2-amino-4-butoxy-5,6,7,8-tetrahydroquinazolin-1-ium-1-yl) ester hydroxide Formula: C12H21N3O6S MolecularWeight: 335.37664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=[N+](C2=C1CCCC2)OS(=O)(=O)O)N.[OH-]

Isomeric SMILES

CCCCOC1=NC(=[N+](C2=C1CCCC2)OS(=O)(=O)O)N.[OH-]

InChI

InChI=1S/C12H19N3O5S.H2O/c1-2-3-8-19-11-9-6-4-5-7-10(9)15(12(13)14-11)20-21(16,17)18;/h13H,2-8H2,1H3,(H,16,17,18);1H2