1-(4-bromophenyl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-1-(4-bromophenyl)ethanone CAS Name: 1-(4-bromophenyl)-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-1-(4-bromophenyl)ethanone Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-1-(4-bromophenyl)ethanone Formula: C19H22BrN2O+ MolecularWeight: 374.29478

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)C2=CC=C(C=C2)Br)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)C2=CC=C(C=C2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C19H21BrN2O/c20-18-8-6-17(7-9-18)19(23)15-22-12-10-21(11-13-22)14-16-4-2-1-3-5-16/h1-9H,10-15H2/p+1