1-(2-fluoranyl-4-nitro-phenyl)-1,4-diazepane

Systemtic Name: 1-(2-fluoranyl-4-nitro-phenyl)-1,4-diazepane Openeye Name: 1-(2-fluoro-4-nitro-phenyl)-1,4-diazepane CAS Name: 1-(2-fluoro-4-nitrophenyl)-1,4-diazepane IUPAC Name: 1-(2-fluoro-4-nitrophenyl)-1,4-diazepane Traditional Name: 1-(2-fluoro-4-nitro-phenyl)-1,4-diazepane Formula: C11H14FN3O2 MolecularWeight: 239.246163

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

C1CNCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C11H14FN3O2/c12-10-8-9(15(16)17)2-3-11(10)14-6-1-4-13-5-7-14/h2-3,8,13H,1,4-7H2