1-phenethyl-2-propan-2-yl-pyridin-1-ium bromide

Systemtic Name: 1-phenethyl-2-propan-2-yl-pyridin-1-ium bromide Openeye Name: 2-isopropyl-1-phenethyl-pyridin-1-ium bromide CAS Name: 1-phenethyl-2-propan-2-ylpyridin-1-ium bromide IUPAC Name: 1-phenethyl-2-propan-2-ylpyridin-1-ium bromide Traditional Name: 2-isopropyl-1-phenethyl-pyridin-1-ium bromide Formula: C16H20BrN MolecularWeight: 306.2407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=[N+]1CCC2=CC=CC=C2.[Br-]

Isomeric SMILES

CC(C)C1=CC=CC=[N+]1CCC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H20N.BrH/c1-14(2)16-10-6-7-12-17(16)13-11-15-8-4-3-5-9-15;/h3-10,12,14H,11,13H2,1-2H3;1H/q+1;/p-1