1-(5-fluoranyl-2-nitro-phenyl)hexan-3-one

Systemtic Name: 1-(5-fluoranyl-2-nitro-phenyl)hexan-3-one Openeye Name: 1-(5-fluoro-2-nitro-phenyl)hexan-3-one CAS Name: 1-(5-fluoro-2-nitrophenyl)-3-hexanone IUPAC Name: 1-(5-fluoro-2-nitrophenyl)hexan-3-one Traditional Name: 1-(5-fluoro-2-nitro-phenyl)hexan-3-one Formula: C12H14FNO3 MolecularWeight: 239.242863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CCC1=C(C=CC(=C1)F)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)CCC1=C(C=CC(=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C12H14FNO3/c1-2-3-11(15)6-4-9-8-10(13)5-7-12(9)14(16)17/h5,7-8H,2-4,6H2,1H3