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

Systemtic Name: 4-(2-fluoranyl-4-nitro-5-piperazin-4-ium-1-yl-phenyl)morpholine Openeye Name: 4-(2-fluoro-4-nitro-5-piperazin-4-ium-1-yl-phenyl)morpholine CAS Name: 4-[2-fluoro-4-nitro-5-(1-piperazin-4-iumyl)phenyl]morpholine IUPAC Name: 4-(2-fluoro-4-nitro-5-piperazin-4-ium-1-ylphenyl)morpholine Traditional Name: 4-(2-fluoro-4-nitro-5-piperazin-4-ium-1-yl-phenyl)morpholine Formula: C14H20FN4O3+ MolecularWeight: 311.332003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCOCC3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCOCC3

InChI

InChI=1S/C14H19FN4O3/c15-11-9-14(19(20)21)13(17-3-1-16-2-4-17)10-12(11)18-5-7-22-8-6-18/h9-10,16H,1-8H2/p+1