N-(4-bromophenyl)-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-bromophenyl)-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-bromophenyl)-4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-(3-chlorobenzyl)piperazin-4-ium-1-carboxamide Formula: C18H20BrClN3O+ MolecularWeight: 409.7279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrClN3O/c19-15-4-6-17(7-5-15)21-18(24)23-10-8-22(9-11-23)13-14-2-1-3-16(20)12-14/h1-7,12H,8-11,13H2,(H,21,24)/p+1