1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(4-bromophenyl)methyl]-4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(4-bromobenzyl)-4-(2,4-dimethoxybenzyl)piperazin-1-ium Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C20H25BrN2O2/c1-24-19-8-5-17(20(13-19)25-2)15-23-11-9-22(10-12-23)14-16-3-6-18(21)7-4-16/h3-8,13H,9-12,14-15H2,1-2H3/p+1