2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuterio-pyrylium-4-yl)pyridine tetrafluoroborate

Systemtic Name: 2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuterio-pyrylium-4-yl)pyridine tetrafluoroborate Openeye Name: 2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuterio-pyrylium-4-yl)pyridine tetrafluoroborate CAS Name: 2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuterio-4-pyryliumyl)pyridine tetrafluoroborate IUPAC Name: 2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuteriopyrylium-4-yl)pyridine tetrafluoroborate Traditional Name: 2,6-ditert-butyl-4-(2,6-ditert-butyl-3,5-dideuterio-pyrylium-4-yl)pyridine tetrafluoroborate Formula: C26H40BF4NO MolecularWeight: 471.418836

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=CC(=N1)C(C)(C)C)C2=CC(=[O+]C(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

[2H]C1=C(C(=C([O+]=C1C(C)(C)C)C(C)(C)C)[2H])C2=CC(=NC(=C2)C(C)(C)C)C(C)(C)C.[B-](F)(F)(F)F

InChI

InChI=1S/C26H40NO.BF4/c1-23(2,3)19-13-17(14-20(27-19)24(4,5)6)18-15-21(25(7,8)9)28-22(16-18)26(10,11)12;2-1(3,4)5/h13-16H,1-12H3;/q+1;-1/i15D,16D;