N-(2-bromophenyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(2-bromophenyl)-4-[(3,4-dichlorophenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-bromophenyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-(3,4-dichlorobenzyl)piperazin-4-ium-1-carboxamide Formula: C18H19BrCl2N3O+ MolecularWeight: 444.17296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC=CC=C3Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C18H18BrCl2N3O/c19-14-3-1-2-4-17(14)22-18(25)24-9-7-23(8-10-24)12-13-5-6-15(20)16(21)11-13/h1-6,11H,7-10,12H2,(H,22,25)/p+1