[4-[[(4-bromanyl-3-nitro-phenyl)carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[(4-bromanyl-3-nitro-phenyl)carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(4-bromo-3-nitro-benzoyl)amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[(4-bromo-3-nitrophenyl)-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(4-bromo-3-nitrobenzoyl)amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(4-bromo-3-nitro-benzoyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C17H19BrN3O3+ MolecularWeight: 393.25506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O3/c1-20(2)11-13-5-3-12(4-6-13)10-19-17(22)14-7-8-15(18)16(9-14)21(23)24/h3-9H,10-11H2,1-2H3,(H,19,22)/p+1