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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-[(4-ethylphenyl)methyl]piperazin-1-ium Openeye Name: 1-[(3-bromophenyl)methyl]-4-[(4-ethylphenyl)methyl]piperazin-1-ium CAS Name: 1-[(3-bromophenyl)methyl]-4-[(4-ethylphenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(3-bromophenyl)methyl]-4-[(4-ethylphenyl)methyl]piperazin-1-ium Traditional Name: 1-(3-bromobenzyl)-4-(4-ethylbenzyl)piperazin-1-ium Formula: C20H26BrN2+ MolecularWeight: 374.33784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CC[NH+](CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H25BrN2/c1-2-17-6-8-18(9-7-17)15-22-10-12-23(13-11-22)16-19-4-3-5-20(21)14-19/h3-9,14H,2,10-13,15-16H2,1H3/p+1