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

Systemtic Name: 1-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)-4-methyl-piperazin-4-ium Openeye Name: 1-(4-fluoro-2-nitro-5-pyrrolidin-1-yl-phenyl)-4-methyl-piperazin-4-ium CAS Name: 1-[4-fluoro-2-nitro-5-(1-pyrrolidinyl)phenyl]-4-methylpiperazin-4-ium IUPAC Name: 1-(4-fluoro-2-nitro-5-pyrrolidin-1-ylphenyl)-4-methylpiperazin-4-ium Traditional Name: 1-(4-fluoro-2-nitro-5-pyrrolidino-phenyl)-4-methyl-piperazin-4-ium Formula: C15H22FN4O2+ MolecularWeight: 309.359183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCC3

InChI

InChI=1S/C15H21FN4O2/c1-17-6-8-19(9-7-17)14-11-13(18-4-2-3-5-18)12(16)10-15(14)20(21)22/h10-11H,2-9H2,1H3/p+1