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

Systemtic Name: 1-ethyl-4-(2-fluoranyl-4-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-ium Openeye Name: 1-ethyl-4-(2-fluoro-4-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-ium CAS Name: 1-ethyl-4-[2-fluoro-4-nitro-5-(1-pyrrolidinyl)phenyl]piperazin-1-ium IUPAC Name: 1-ethyl-4-(2-fluoro-4-nitro-5-pyrrolidin-1-ylphenyl)piperazin-1-ium Traditional Name: 1-ethyl-4-(2-fluoro-4-nitro-5-pyrrolidino-phenyl)piperazin-1-ium Formula: C16H24FN4O2+ MolecularWeight: 323.385763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23FN4O2/c1-2-18-7-9-20(10-8-18)14-12-15(19-5-3-4-6-19)16(21(22)23)11-13(14)17/h11-12H,2-10H2,1H3/p+1