2-heptan-3-yl-1-methyl-pyridin-1-ium tetrafluoroborate

Systemtic Name: 2-heptan-3-yl-1-methyl-pyridin-1-ium tetrafluoroborate Openeye Name: 2-(1-ethylpentyl)-1-methyl-pyridin-1-ium tetrafluoroborate CAS Name: 2-heptan-3-yl-1-methylpyridin-1-ium tetrafluoroborate IUPAC Name: 2-heptan-3-yl-1-methylpyridin-1-ium tetrafluoroborate Traditional Name: 2-(1-ethylpentyl)-1-methyl-pyridin-1-ium tetrafluoroborate Formula: C13H22BF4N MolecularWeight: 279.125093

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCC(CC)C1=CC=CC=[N+]1C

Isomeric SMILES

[B-](F)(F)(F)F.CCCCC(CC)C1=CC=CC=[N+]1C

InChI

InChI=1S/C13H22N.BF4/c1-4-6-9-12(5-2)13-10-7-8-11-14(13)3;2-1(3,4)5/h7-8,10-12H,4-6,9H2,1-3H3;/q+1;-1