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

Systemtic Name: [4-[[(5-bromanylpyridin-3-yl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(5-bromopyridine-3-carbonyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[(5-bromo-3-pyridinyl)-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(5-bromopyridine-3-carbonyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[(5-bromonicotinoyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C18H23BrN3O+ MolecularWeight: 377.29872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrN3O/c1-3-22(4-2)13-15-7-5-14(6-8-15)10-21-18(23)16-9-17(19)12-20-11-16/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,21,23)/p+1