(2,4-dimethyl-6-piperidin-1-yl-pyridin-1-ium-3-yl) hydrogen sulfate hydroxide

Systemtic Name: (2,4-dimethyl-6-piperidin-1-yl-pyridin-1-ium-3-yl) hydrogen sulfate hydroxide Openeye Name: [2,4-dimethyl-6-(1-piperidyl)pyridin-1-ium-3-yl] hydrogen sulfate hydroxide CAS Name: sulfuric acid [2,4-dimethyl-6-(1-piperidinyl)-3-pyridin-1-iumyl] ester hydroxide IUPAC Name: (2,4-dimethyl-6-piperidin-1-ylpyridin-1-ium-3-yl) hydrogen sulfate hydroxide Traditional Name: sulfuric acid (2,4-dimethyl-6-piperidino-pyridin-1-ium-3-yl) ester hydroxide Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1OS(=O)(=O)O)C)N2CCCCC2.[OH-]

Isomeric SMILES

CC1=CC(=[NH+]C(=C1OS(=O)(=O)O)C)N2CCCCC2.[OH-]

InChI

InChI=1S/C12H18N2O4S.H2O/c1-9-8-11(14-6-4-3-5-7-14)13-10(2)12(9)18-19(15,16)17;/h8H,3-7H2,1-2H3,(H,15,16,17);1H2