4-[[2-(2-methylpentan-2-yl)pyridin-1-ium-1-yl]methyl]phenol chloride

Systemtic Name: 4-[[2-(2-methylpentan-2-yl)pyridin-1-ium-1-yl]methyl]phenol chloride Openeye Name: 4-[[2-(1,1-dimethylbutyl)pyridin-1-ium-1-yl]methyl]phenol chloride CAS Name: 4-[[2-(2-methylpentan-2-yl)-1-pyridin-1-iumyl]methyl]phenol chloride IUPAC Name: 4-[[2-(2-methylpentan-2-yl)pyridin-1-ium-1-yl]methyl]phenol chloride Traditional Name: 4-[[2-(1,1-dimethylbutyl)pyridin-1-ium-1-yl]methyl]phenol chloride Formula: C18H24ClNO MolecularWeight: 305.84226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC=CC=[N+]1CC2=CC=C(C=C2)O.[Cl-]

Isomeric SMILES

CCCC(C)(C)C1=CC=CC=[N+]1CC2=CC=C(C=C2)O.[Cl-]

InChI

InChI=1S/C18H23NO.ClH/c1-4-12-18(2,3)17-7-5-6-13-19(17)14-15-8-10-16(20)11-9-15;/h5-11,13H,4,12,14H2,1-3H3;1H