2-methyl-4,6-diphenyl-1-propyl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 2-methyl-4,6-diphenyl-1-propyl-pyridin-1-ium tetrafluoroborate Openeye Name: 2-methyl-4,6-diphenyl-1-propyl-pyridin-1-ium tetrafluoroborate CAS Name: 2-methyl-4,6-diphenyl-1-propylpyridin-1-ium tetrafluoroborate IUPAC Name: 2-methyl-4,6-diphenyl-1-propylpyridin-1-ium tetrafluoroborate Traditional Name: 2-methyl-4,6-diphenyl-1-propyl-pyridin-1-ium tetrafluoroborate Formula: C21H22BF4N MolecularWeight: 375.210693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC[N+]1=C(C=C(C=C1C)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[B-](F)(F)(F)F.CCC[N+]1=C(C=C(C=C1C)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N.BF4/c1-3-14-22-17(2)15-20(18-10-6-4-7-11-18)16-21(22)19-12-8-5-9-13-19;2-1(3,4)5/h4-13,15-16H,3,14H2,1-2H3;/q+1;-1