[4-[(dimethylazaniumyl)methyl]-5-oxidanyl-6-phenyl-pyridin-1-ium-2-yl]methyl-dimethyl-azanium trichloride

Systemtic Name: [4-[(dimethylazaniumyl)methyl]-5-oxidanyl-6-phenyl-pyridin-1-ium-2-yl]methyl-dimethyl-azanium trichloride Openeye Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenyl-pyridin-1-ium-2-yl]methyl-dimethyl-ammonium trichloride CAS Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenyl-2-pyridin-1-iumyl]methyl-dimethylammonium trichloride IUPAC Name: [4-[(dimethylazaniumyl)methyl]-5-hydroxy-6-phenylpyridin-1-ium-2-yl]methyl-dimethylazanium trichloride Traditional Name: [4-[(dimethylammonio)methyl]-5-hydroxy-6-phenyl-pyridin-1-ium-2-yl]methyl-dimethyl-ammonium trichloride Formula: C17H26Cl3N3O MolecularWeight: 394.76684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC(=[NH+]C(=C1O)C2=CC=CC=C2)C[NH+](C)C.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CC1=CC(=[NH+]C(=C1O)C2=CC=CC=C2)C[NH+](C)C.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C17H23N3O.3ClH/c1-19(2)11-14-10-15(12-20(3)4)18-16(17(14)21)13-8-6-5-7-9-13;;;/h5-10,21H,11-12H2,1-4H3;3*1H