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

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(2-bromophenyl)methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(2-bromophenyl)methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(2-bromophenyl)methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-(2-bromobenzyl)-4-phenyl-piperazin-1-ium Formula: C17H20BrN2+ MolecularWeight: 332.2581

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Br)C3=CC=CC=C3

InChI

InChI=1S/C17H19BrN2/c18-17-9-5-4-6-15(17)14-19-10-12-20(13-11-19)16-7-2-1-3-8-16/h1-9H,10-14H2/p+1