1-dodecyl-4-pyridin-4-yl-pyridin-1-ium bromide

Systemtic Name: 1-dodecyl-4-pyridin-4-yl-pyridin-1-ium bromide Openeye Name: 1-dodecyl-4-(4-pyridyl)pyridin-1-ium bromide CAS Name: 1-dodecyl-4-pyridin-4-ylpyridin-1-ium bromide IUPAC Name: 1-dodecyl-4-pyridin-4-ylpyridin-1-ium bromide Traditional Name: 1-lauryl-4-(4-pyridyl)pyridin-1-ium bromide Formula: C22H33BrN2 MolecularWeight: 405.41482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N2.BrH/c1-2-3-4-5-6-7-8-9-10-11-18-24-19-14-22(15-20-24)21-12-16-23-17-13-21;/h12-17,19-20H,2-11,18H2,1H3;1H/q+1;/p-1