[4-[[(5-bromanylpyridin-3-yl)carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[(5-bromanylpyridin-3-yl)carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(5-bromopyridine-3-carbonyl)amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[(5-bromo-3-pyridinyl)-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(5-bromopyridine-3-carbonyl)amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(5-bromonicotinoyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C16H19BrN3O+ MolecularWeight: 349.24556

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C16H18BrN3O/c1-20(2)11-13-5-3-12(4-6-13)8-19-16(21)14-7-15(17)10-18-9-14/h3-7,9-10H,8,11H2,1-2H3,(H,19,21)/p+1