1-phenethyl-2,3,5,6-tetraphenyl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 1-phenethyl-2,3,5,6-tetraphenyl-pyridin-1-ium tetrafluoroborate Openeye Name: 1-phenethyl-2,3,5,6-tetraphenyl-pyridin-1-ium tetrafluoroborate CAS Name: 1-phenethyl-2,3,5,6-tetraphenylpyridin-1-ium tetrafluoroborate IUPAC Name: 1-phenethyl-2,3,5,6-tetraphenylpyridin-1-ium tetrafluoroborate Traditional Name: 1-phenethyl-2,3,5,6-tetraphenyl-pyridin-1-ium tetrafluoroborate Formula: C37H30BF4N MolecularWeight: 575.445413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)CC[N+]2=C(C(=CC(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)CC[N+]2=C(C(=CC(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H30N.BF4/c1-6-16-29(17-7-1)26-27-38-36(32-22-12-4-13-23-32)34(30-18-8-2-9-19-30)28-35(31-20-10-3-11-21-31)37(38)33-24-14-5-15-25-33;2-1(3,4)5/h1-25,28H,26-27H2;/q+1;-1