3-bromanyl-1-octadecyl-pyridin-1-ium

Systemtic Name: 3-bromanyl-1-octadecyl-pyridin-1-ium Openeye Name: 3-bromo-1-octadecyl-pyridin-1-ium CAS Name: 3-bromo-1-octadecylpyridin-1-ium IUPAC Name: 3-bromo-1-octadecylpyridin-1-ium Traditional Name: 3-bromo-1-stearyl-pyridin-1-ium Formula: C23H41BrN+ MolecularWeight: 411.48234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)Br

InChI

InChI=1S/C23H41BrN/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25-21-18-19-23(24)22-25/h18-19,21-22H,2-17,20H2,1H3/q+1