[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methanamine tetrafluoroborate

Systemtic Name: [4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methanamine tetrafluoroborate Openeye Name: [4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methanamine tetrafluoroborate CAS Name: [4-[(3-methyl-1-imidazol-3-iumyl)methyl]phenyl]methanamine tetrafluoroborate IUPAC Name: [4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methanamine tetrafluoroborate Traditional Name: [4-[(3-methylimidazol-3-ium-1-yl)methyl]benzyl]amine tetrafluoroborate Formula: C12H16BF4N3 MolecularWeight: 289.080153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CN(C=C1)CC2=CC=C(C=C2)CN

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CN(C=C1)CC2=CC=C(C=C2)CN

InChI

InChI=1S/C12H16N3.BF4/c1-14-6-7-15(10-14)9-12-4-2-11(8-13)3-5-12;2-1(3,4)5/h2-7,10H,8-9,13H2,1H3;/q+1;-1