dioxidanium; zinc; 5-methylpiperidin-1-ide-2-sulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid

Systemtic Name: dioxidanium; zinc; 5-methylpiperidin-1-ide-2-sulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid Openeye Name: dioxonium; zinc; 5-methylpiperidin-1-ide-2-sulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid CAS Name: dioxonium; zinc; 5-methyl-2-piperidin-1-idesulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid IUPAC Name: dioxidanium; zinc; 5-methylpiperidin-1-ide-2-sulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid Traditional Name: dioxonium; zinc; 5-methylpiperidin-1-ide-2-sulfonic acid; 5-methyl-2H-pyridin-1-ide-2-sulfonic acid Formula: C12H26N2O8S2Zn+2 MolecularWeight: 455.88244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC([N-]C1)S(=O)(=O)O.CC1=C[N-]C(C=C1)S(=O)(=O)O.[OH3+].[OH3+].[Zn+2]

Isomeric SMILES

CC1CCC([N-]C1)S(=O)(=O)O.CC1=C[N-]C(C=C1)S(=O)(=O)O.[OH3+].[OH3+].[Zn+2]

InChI

InChI=1S/C6H12NO3S.C6H8NO3S.2H2O.Zn/c2*1-5-2-3-6(7-4-5)11(8,9)10;;;/h5-6H,2-4H2,1H3,(H,8,9,10);2-4,6H,1H3,(H,8,9,10);2*1H2;/q2*-1;;;+2/p+2