1-butyl-3-[[(2S)-pyrrolidin-2-yl]methyl]imidazol-3-ium tetrafluoroborate

Systemtic Name: 1-butyl-3-[[(2S)-pyrrolidin-2-yl]methyl]imidazol-3-ium tetrafluoroborate Openeye Name: 1-butyl-3-[[(2S)-pyrrolidin-2-yl]methyl]imidazol-3-ium tetrafluoroborate CAS Name: 1-butyl-3-[[(2S)-2-pyrrolidinyl]methyl]imidazol-3-ium tetrafluoroborate IUPAC Name: 1-butyl-3-[[(2S)-pyrrolidin-2-yl]methyl]imidazol-3-ium tetrafluoroborate Traditional Name: 1-butyl-3-[[(2S)-pyrrolidin-2-yl]methyl]imidazol-3-ium tetrafluoroborate Formula: C12H22BF4N3 MolecularWeight: 295.127793

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCN1C=C[N+](=C1)CC2CCCN2

Isomeric SMILES

[B-](F)(F)(F)F.CCCCN1C=C[N+](=C1)C[C@@H]2CCCN2

InChI

InChI=1S/C12H22N3.BF4/c1-2-3-7-14-8-9-15(11-14)10-12-5-4-6-13-12;2-1(3,4)5/h8-9,11-13H,2-7,10H2,1H3;/q+1;-1/t12-;/m0./s1