(2-azanyl-6-ethyl-4-piperidin-1-yl-pyridin-1-ium-1-yl) hydrogen sulfate

Systemtic Name: (2-azanyl-6-ethyl-4-piperidin-1-yl-pyridin-1-ium-1-yl) hydrogen sulfate Openeye Name: [2-amino-6-ethyl-4-(1-piperidyl)pyridin-1-ium-1-yl] hydrogen sulfate CAS Name: sulfuric acid [2-amino-6-ethyl-4-(1-piperidinyl)-1-pyridin-1-iumyl] ester IUPAC Name: (2-amino-6-ethyl-4-piperidin-1-ylpyridin-1-ium-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (2-amino-6-ethyl-4-piperidino-pyridin-1-ium-1-yl) ester Formula: C12H20N3O4S+ MolecularWeight: 302.3699

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(=CC(=C1)N2CCCCC2)N)OS(=O)(=O)O

Isomeric SMILES

CCC1=[N+](C(=CC(=C1)N2CCCCC2)N)OS(=O)(=O)O

InChI

InChI=1S/C12H19N3O4S/c1-2-10-8-11(14-6-4-3-5-7-14)9-12(13)15(10)19-20(16,17)18/h8-9,13H,2-7H2,1H3,(H,16,17,18)/p+1