1-(4-bromanyl-5-fluoranyl-2-nitro-phenyl)-4-methyl-piperazin-4-ium

Systemtic Name: 1-(4-bromanyl-5-fluoranyl-2-nitro-phenyl)-4-methyl-piperazin-4-ium Openeye Name: 1-(4-bromo-5-fluoro-2-nitro-phenyl)-4-methyl-piperazin-4-ium CAS Name: 1-(4-bromo-5-fluoro-2-nitrophenyl)-4-methylpiperazin-4-ium IUPAC Name: 1-(4-bromo-5-fluoro-2-nitrophenyl)-4-methylpiperazin-4-ium Traditional Name: 1-(4-bromo-5-fluoro-2-nitro-phenyl)-4-methyl-piperazin-4-ium Formula: C11H14BrFN3O2+ MolecularWeight: 319.150163

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])Br)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])Br)F

InChI

InChI=1S/C11H13BrFN3O2/c1-14-2-4-15(5-3-14)10-7-9(13)8(12)6-11(10)16(17)18/h6-7H,2-5H2,1H3/p+1