2-[4-[(4-bromophenyl)methyl]piperazin-1-ium-1-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-ium-1-yl]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-ium-1-yl]-N-isobutyl-acetamide CAS Name: 2-[4-[(4-bromophenyl)methyl]-1-piperazin-1-iumyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-ium-1-yl]-N-(2-methylpropyl)acetamide Traditional Name: 2-[4-(4-bromobenzyl)piperazin-1-ium-1-yl]-N-isobutyl-acetamide Formula: C17H27BrN3O+ MolecularWeight: 369.31978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C[NH+]1CCN(CC1)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CNC(=O)C[NH+]1CCN(CC1)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H26BrN3O/c1-14(2)11-19-17(22)13-21-9-7-20(8-10-21)12-15-3-5-16(18)6-4-15/h3-6,14H,7-13H2,1-2H3,(H,19,22)/p+1