4-tert-butyl-1-phenylmethoxy-pyridin-1-ium bromide

Systemtic Name: 4-tert-butyl-1-phenylmethoxy-pyridin-1-ium bromide Openeye Name: 1-benzyloxy-4-tert-butyl-pyridin-1-ium bromide CAS Name: 4-tert-butyl-1-phenylmethoxypyridin-1-ium bromide IUPAC Name: 4-tert-butyl-1-phenylmethoxypyridin-1-ium bromide Traditional Name: 1-benzoxy-4-tert-butyl-pyridin-1-ium bromide Formula: C16H20BrNO MolecularWeight: 322.2401

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=[N+](C=C1)OCC2=CC=CC=C2.[Br-]

Isomeric SMILES

CC(C)(C)C1=CC=[N+](C=C1)OCC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H20NO.BrH/c1-16(2,3)15-9-11-17(12-10-15)18-13-14-7-5-4-6-8-14;/h4-12H,13H2,1-3H3;1H/q+1;/p-1