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

Systemtic Name: 1-(2-fluoranyl-4-nitro-5-piperazin-4-ium-1-yl-phenyl)-4-methyl-piperazin-4-ium Openeye Name: 1-(2-fluoro-4-nitro-5-piperazin-4-ium-1-yl-phenyl)-4-methyl-piperazin-4-ium CAS Name: 1-[2-fluoro-4-nitro-5-(1-piperazin-4-iumyl)phenyl]-4-methylpiperazin-4-ium IUPAC Name: 1-(2-fluoro-4-nitro-5-piperazin-4-ium-1-ylphenyl)-4-methylpiperazin-4-ium Traditional Name: 1-(2-fluoro-4-nitro-5-piperazin-4-ium-1-yl-phenyl)-4-methyl-piperazin-4-ium Formula: C15H24FN5O2+2 MolecularWeight: 325.381763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C(=C2)N3CC[NH2+]CC3)[N+](=O)[O-])F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C(=C2)N3CC[NH2+]CC3)[N+](=O)[O-])F

InChI

InChI=1S/C15H22FN5O2/c1-18-6-8-20(9-7-18)13-11-14(19-4-2-17-3-5-19)15(21(22)23)10-12(13)16/h10-11,17H,2-9H2,1H3/p+2