1-[(2-bromophenyl)methyl]-4-[(2S)-butan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-[(2S)-butan-2-yl]piperazin-4-ium Openeye Name: 1-[(2-bromophenyl)methyl]-4-[(1S)-1-methylpropyl]piperazin-4-ium CAS Name: 1-[(2-bromophenyl)methyl]-4-[(2S)-butan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2-bromophenyl)methyl]-4-[(2S)-butan-2-yl]piperazin-4-ium Traditional Name: 1-(2-bromobenzyl)-4-[(1S)-1-methylpropyl]piperazin-4-ium Formula: C15H24BrN2+ MolecularWeight: 312.26846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]1CCN(CC1)CC2=CC=CC=C2Br

Isomeric SMILES

CC[C@H](C)[NH+]1CCN(CC1)CC2=CC=CC=C2Br

InChI

InChI=1S/C15H23BrN2/c1-3-13(2)18-10-8-17(9-11-18)12-14-6-4-5-7-15(14)16/h4-7,13H,3,8-12H2,1-2H3/p+1/t13-/m0/s1