[2-[[(4-bromanyl-2-nitro-phenyl)amino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[(4-bromanyl-2-nitro-phenyl)amino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[(4-bromo-2-nitro-anilino)methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[(4-bromo-2-nitroanilino)methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[(4-bromo-2-nitroanilino)methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[(4-bromo-2-nitro-anilino)methyl]benzyl]-dimethyl-ammonium Formula: C16H19BrN3O2+ MolecularWeight: 365.24496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H18BrN3O2/c1-19(2)11-13-6-4-3-5-12(13)10-18-15-8-7-14(17)9-16(15)20(21)22/h3-9,18H,10-11H2,1-2H3/p+1