1-(2-fluoranyl-4-nitro-5-piperidin-1-yl-phenyl)azepane

Systemtic Name: 1-(2-fluoranyl-4-nitro-5-piperidin-1-yl-phenyl)azepane Openeye Name: 1-[2-fluoro-4-nitro-5-(1-piperidyl)phenyl]azepane CAS Name: 1-[2-fluoro-4-nitro-5-(1-piperidinyl)phenyl]azepane IUPAC Name: 1-(2-fluoro-4-nitro-5-piperidin-1-ylphenyl)azepane Traditional Name: 1-(2-fluoro-4-nitro-5-piperidino-phenyl)azepane Formula: C17H24FN3O2 MolecularWeight: 321.389763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C(=C2)N3CCCCC3)[N+](=O)[O-])F

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C(=C2)N3CCCCC3)[N+](=O)[O-])F

InChI

InChI=1S/C17H24FN3O2/c18-14-12-17(21(22)23)16(20-10-6-3-7-11-20)13-15(14)19-8-4-1-2-5-9-19/h12-13H,1-11H2