(4-bromophenyl)methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: (4-bromophenyl)methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (4-bromophenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (4-bromophenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (4-bromophenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (4-bromobenzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C13H17BrN3+ MolecularWeight: 295.19818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CCCN2C=CN=C2)Br

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]CCCN2C=CN=C2)Br

InChI

InChI=1S/C13H16BrN3/c14-13-4-2-12(3-5-13)10-15-6-1-8-17-9-7-16-11-17/h2-5,7,9,11,15H,1,6,8,10H2/p+1