1-(5-fluoranyl-2-nitro-phenyl)-4,4-dimethyl-pentan-3-one

Systemtic Name: 1-(5-fluoranyl-2-nitro-phenyl)-4,4-dimethyl-pentan-3-one Openeye Name: 1-(5-fluoro-2-nitro-phenyl)-4,4-dimethyl-pentan-3-one CAS Name: 1-(5-fluoro-2-nitrophenyl)-4,4-dimethyl-3-pentanone IUPAC Name: 1-(5-fluoro-2-nitrophenyl)-4,4-dimethylpentan-3-one Traditional Name: 1-(5-fluoro-2-nitro-phenyl)-4,4-dimethyl-pentan-3-one Formula: C13H16FNO3 MolecularWeight: 253.269443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16FNO3/c1-13(2,3)12(16)7-4-9-8-10(14)5-6-11(9)15(17)18/h5-6,8H,4,7H2,1-3H3