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

Systemtic Name: 4-[[2-(2-methylpentan-2-yl)pyridin-1-ium-1-yl]methyl]phenol Openeye Name: 4-[[2-(1,1-dimethylbutyl)pyridin-1-ium-1-yl]methyl]phenol CAS Name: 4-[[2-(2-methylpentan-2-yl)-1-pyridin-1-iumyl]methyl]phenol IUPAC Name: 4-[[2-(2-methylpentan-2-yl)pyridin-1-ium-1-yl]methyl]phenol Traditional Name: 4-[[2-(1,1-dimethylbutyl)pyridin-1-ium-1-yl]methyl]phenol Formula: C18H24NO+ MolecularWeight: 270.38926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO/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/p+1