2,2,8,8-tetramethyl-5-pyridin-1-ium-2-yl-nonane-3,7-dione tetrafluoroborate

Systemtic Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-2-yl-nonane-3,7-dione tetrafluoroborate Openeye Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-2-yl-nonane-3,7-dione tetrafluoroborate CAS Name: 2,2,8,8-tetramethyl-5-(2-pyridin-1-iumyl)nonane-3,7-dione tetrafluoroborate IUPAC Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-2-ylnonane-3,7-dione tetrafluoroborate Traditional Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-2-yl-nonane-3,7-dione tetrafluoroborate Formula: C18H28BF4NO2 MolecularWeight: 377.225033

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C(=O)CC(CC(=O)C(C)(C)C)C1=CC=CC=[NH+]1

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)C(=O)CC(CC(=O)C(C)(C)C)C1=CC=CC=[NH+]1

InChI

InChI=1S/C18H27NO2.BF4/c1-17(2,3)15(20)11-13(12-16(21)18(4,5)6)14-9-7-8-10-19-14;2-1(3,4)5/h7-10,13H,11-12H2,1-6H3;/q;-1/p+1