1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-1-ium

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-1-ium Openeye Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-1-ium CAS Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazin-1-ium Traditional Name: 1-(3-bromobenzyl)-4-(2-fluorobenzyl)piperazin-1-ium Formula: C18H21BrFN2+ MolecularWeight: 364.275143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Br)CC3=CC=CC=C3F

Isomeric SMILES

C1CN(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+1