3-[(5-bromanylpyridin-2-yl)amino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(5-bromanylpyridin-2-yl)amino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(5-bromo-2-pyridyl)amino]propyl]-methyl-ammonium CAS Name: 3-[(5-bromo-2-pyridinyl)amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(5-bromopyridin-2-yl)amino]propyl]-methylazanium Traditional Name: benzyl-[3-[(5-bromo-2-pyridyl)amino]propyl]-methyl-ammonium Formula: C16H21BrN3+ MolecularWeight: 335.26204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC1=NC=C(C=C1)Br)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCCNC1=NC=C(C=C1)Br)CC2=CC=CC=C2

InChI

InChI=1S/C16H20BrN3/c1-20(13-14-6-3-2-4-7-14)11-5-10-18-16-9-8-15(17)12-19-16/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,18,19)/p+1