1-(2-butoxy-2-phenyl-ethyl)pyridin-1-ium bromide

Systemtic Name: 1-(2-butoxy-2-phenyl-ethyl)pyridin-1-ium bromide Openeye Name: 1-(2-butoxy-2-phenyl-ethyl)pyridin-1-ium bromide CAS Name: 1-(2-butoxy-2-phenylethyl)pyridin-1-ium bromide IUPAC Name: 1-(2-butoxy-2-phenylethyl)pyridin-1-ium bromide Traditional Name: 1-(2-butoxy-2-phenyl-ethyl)pyridin-1-ium bromide Formula: C17H22BrNO MolecularWeight: 336.26668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22NO.BrH/c1-2-3-14-19-17(16-10-6-4-7-11-16)15-18-12-8-5-9-13-18;/h4-13,17H,2-3,14-15H2,1H3;1H/q+1;/p-1