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

Systemtic Name: 1-(2-fluoranyl-5-methyl-4-nitro-phenyl)piperazin-4-ium Openeye Name: 1-(2-fluoro-5-methyl-4-nitro-phenyl)piperazin-4-ium CAS Name: 1-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-4-ium IUPAC Name: 1-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-4-ium Traditional Name: 1-(2-fluoro-5-methyl-4-nitro-phenyl)piperazin-4-ium Formula: C11H15FN3O2+ MolecularWeight: 240.254103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1[N+](=O)[O-])F)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=C(C=C1[N+](=O)[O-])F)N2CC[NH2+]CC2

InChI

InChI=1S/C11H14FN3O2/c1-8-6-11(14-4-2-13-3-5-14)9(12)7-10(8)15(16)17/h6-7,13H,2-5H2,1H3/p+1