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

Systemtic Name: 1-[(2S)-butan-2-yl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium Openeye Name: 1-[(4-chlorophenyl)methyl]-4-[(1S)-1-methylpropyl]piperazin-4-ium CAS Name: 1-[(2S)-butan-2-yl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(2S)-butan-2-yl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium Traditional Name: 1-(4-chlorobenzyl)-4-[(1S)-1-methylpropyl]piperazin-4-ium Formula: C15H24ClN2+ MolecularWeight: 267.81746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]1CCN(CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[C@H](C)[NH+]1CCN(CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H23ClN2/c1-3-13(2)18-10-8-17(9-11-18)12-14-4-6-15(16)7-5-14/h4-7,13H,3,8-12H2,1-2H3/p+1/t13-/m0/s1