1-butyl-4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium tetrafluoroborate

Systemtic Name: 1-butyl-4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium tetrafluoroborate Openeye Name: 1-butyl-2,6-diisopropyl-4-phenyl-pyridin-1-ium tetrafluoroborate CAS Name: 1-butyl-4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium tetrafluoroborate IUPAC Name: 1-butyl-4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium tetrafluoroborate Traditional Name: 1-butyl-2,6-diisopropyl-4-phenyl-pyridin-1-ium tetrafluoroborate Formula: C21H30BF4N MolecularWeight: 383.274213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCC[N+]1=C(C=C(C=C1C(C)C)C2=CC=CC=C2)C(C)C

Isomeric SMILES

[B-](F)(F)(F)F.CCCC[N+]1=C(C=C(C=C1C(C)C)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H30N.BF4/c1-6-7-13-22-20(16(2)3)14-19(15-21(22)17(4)5)18-11-9-8-10-12-18;2-1(3,4)5/h8-12,14-17H,6-7,13H2,1-5H3;/q+1;-1