1-heptan-2-yl-2,4,6-triphenyl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 1-heptan-2-yl-2,4,6-triphenyl-pyridin-1-ium tetrafluoroborate Openeye Name: 1-(1-methylhexyl)-2,4,6-triphenyl-pyridin-1-ium tetrafluoroborate CAS Name: 1-heptan-2-yl-2,4,6-triphenylpyridin-1-ium tetrafluoroborate IUPAC Name: 1-heptan-2-yl-2,4,6-triphenylpyridin-1-ium tetrafluoroborate Traditional Name: 1-(1-methylhexyl)-2,4,6-triphenyl-pyridin-1-ium tetrafluoroborate Formula: C30H32BF4N MolecularWeight: 493.386393

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCCC(C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CCCCCC(C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H32N.BF4/c1-3-4-8-15-24(2)31-29(26-18-11-6-12-19-26)22-28(25-16-9-5-10-17-25)23-30(31)27-20-13-7-14-21-27;2-1(3,4)5/h5-7,9-14,16-24H,3-4,8,15H2,1-2H3;/q+1;-1