1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine-1,4-diium Openeye Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine-1,4-diium CAS Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(3-bromobenzyl)-4-(2-fluorobenzyl)piperazine-1,4-diium Formula: C18H22BrFN2+2 MolecularWeight: 365.283083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Br)CC3=CC=CC=C3F

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Br)CC3=CC=CC=C3F

InChI

InChI=1S/C18H20BrFN2/c19-17-6-3-4-15(12-17)13-21-8-10-22(11-9-21)14-16-5-1-2-7-18(16)20/h1-7,12H,8-11,13-14H2/p+2