2,6-didodecoxy-1-methyl-4-phenyl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 2,6-didodecoxy-1-methyl-4-phenyl-pyridin-1-ium tetrafluoroborate Openeye Name: 2,6-didodecoxy-1-methyl-4-phenyl-pyridin-1-ium tetrafluoroborate CAS Name: 2,6-didodecoxy-1-methyl-4-phenylpyridin-1-ium tetrafluoroborate IUPAC Name: 2,6-didodecoxy-1-methyl-4-phenylpyridin-1-ium tetrafluoroborate Traditional Name: 2,6-dilauryloxy-1-methyl-4-phenyl-pyridin-1-ium tetrafluoroborate Formula: C36H60BF4NO2 MolecularWeight: 625.671713

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCCCCCCCCCOC1=CC(=CC(=[N+]1C)OCCCCCCCCCCCC)C2=CC=CC=C2

Isomeric SMILES

[B-](F)(F)(F)F.CCCCCCCCCCCCOC1=CC(=CC(=[N+]1C)OCCCCCCCCCCCC)C2=CC=CC=C2

InChI

InChI=1S/C36H60NO2.BF4/c1-4-6-8-10-12-14-16-18-20-25-29-38-35-31-34(33-27-23-22-24-28-33)32-36(37(35)3)39-30-26-21-19-17-15-13-11-9-7-5-2;2-1(3,4)5/h22-24,27-28,31-32H,4-21,25-26,29-30H2,1-3H3;/q+1;-1