[2-azanyl-6-(diethylamino)-4-pyrrolidin-1-yl-pyridin-1-ium-1-yl] hydrogen sulfate hydroxide

Systemtic Name: [2-azanyl-6-(diethylamino)-4-pyrrolidin-1-yl-pyridin-1-ium-1-yl] hydrogen sulfate hydroxide Openeye Name: [2-amino-6-(diethylamino)-4-pyrrolidin-1-yl-pyridin-1-ium-1-yl] hydrogen sulfate hydroxide CAS Name: sulfuric acid [2-amino-6-(diethylamino)-4-(1-pyrrolidinyl)-1-pyridin-1-iumyl] ester hydroxide IUPAC Name: [2-amino-6-(diethylamino)-4-pyrrolidin-1-ylpyridin-1-ium-1-yl] hydrogen sulfate hydroxide Traditional Name: sulfuric acid [2-amino-6-(diethylamino)-4-pyrrolidino-pyridin-1-ium-1-yl] ester hydroxide Formula: C13H24N4O5S MolecularWeight: 348.41846

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=CC(=[N+]1OS(=O)(=O)O)N)N2CCCC2.[OH-]

Isomeric SMILES

CCN(CC)C1=CC(=CC(=[N+]1OS(=O)(=O)O)N)N2CCCC2.[OH-]

InChI

InChI=1S/C13H22N4O4S.H2O/c1-3-15(4-2)13-10-11(16-7-5-6-8-16)9-12(14)17(13)21-22(18,19)20;/h9-10,14H,3-8H2,1-2H3,(H,18,19,20);1H2