(3-bromophenyl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3-bromophenyl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (3-bromophenyl)methyl-(4-pyridylmethyl)ammonium CAS Name: (3-bromophenyl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3-bromophenyl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: (3-bromobenzyl)-(4-pyridylmethyl)ammonium Formula: C13H14BrN2+ MolecularWeight: 278.16766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C[NH2+]CC2=CC=NC=C2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C[NH2+]CC2=CC=NC=C2

InChI

InChI=1S/C13H13BrN2/c14-13-3-1-2-12(8-13)10-16-9-11-4-6-15-7-5-11/h1-8,16H,9-10H2/p+1