(3-bromophenyl)-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-bromophenyl)-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(3-chlorobenzyl)piperazin-4-ium-1-yl]methanone Formula: C18H19BrClN2O+ MolecularWeight: 394.71326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H18BrClN2O/c19-16-5-2-4-15(12-16)18(23)22-9-7-21(8-10-22)13-14-3-1-6-17(20)11-14/h1-6,11-12H,7-10,13H2/p+1