[2-tert-butyl-6-[(dimethylazaniumyl)methyl]-3-oxidanyl-pyridin-1-ium-4-yl]methyl-dimethyl-azanium trichloride

Systemtic Name: [2-tert-butyl-6-[(dimethylazaniumyl)methyl]-3-oxidanyl-pyridin-1-ium-4-yl]methyl-dimethyl-azanium trichloride Openeye Name: [2-tert-butyl-6-[(dimethylammonio)methyl]-3-hydroxy-pyridin-1-ium-4-yl]methyl-dimethyl-ammonium trichloride CAS Name: [2-tert-butyl-6-[(dimethylammonio)methyl]-3-hydroxy-4-pyridin-1-iumyl]methyl-dimethylammonium trichloride IUPAC Name: [2-tert-butyl-6-[(dimethylazaniumyl)methyl]-3-hydroxypyridin-1-ium-4-yl]methyl-dimethylazanium trichloride Traditional Name: [2-tert-butyl-6-[(dimethylammonio)methyl]-3-hydroxy-pyridin-1-ium-4-yl]methyl-dimethyl-ammonium trichloride Formula: C15H30Cl3N3O MolecularWeight: 374.7772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=[NH+]1)C[NH+](C)C)C[NH+](C)C)O.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=[NH+]1)C[NH+](C)C)C[NH+](C)C)O.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C15H27N3O.3ClH/c1-15(2,3)14-13(19)11(9-17(4)5)8-12(16-14)10-18(6)7;;;/h8,19H,9-10H2,1-7H3;3*1H