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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[(3-bromophenyl)methyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[(3-bromophenyl)methyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[(3-bromophenyl)methyl]-4-ethylpiperazin-4-ium Traditional Name: 1-(3-bromobenzyl)-4-ethyl-piperazin-4-ium Formula: C13H20BrN2+ MolecularWeight: 284.2153

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrN2/c1-2-15-6-8-16(9-7-15)11-12-4-3-5-13(14)10-12/h3-5,10H,2,6-9,11H2,1H3/p+1