3-nitro-4-[2-(trifluoromethyl)phenyl]butan-2-one

Systemtic Name: 3-nitro-4-[2-(trifluoromethyl)phenyl]butan-2-one Openeye Name: 3-nitro-4-[2-(trifluoromethyl)phenyl]butan-2-one CAS Name: 3-nitro-4-[2-(trifluoromethyl)phenyl]-2-butanone IUPAC Name: 3-nitro-4-[2-(trifluoromethyl)phenyl]butan-2-one Traditional Name: 3-nitro-4-[2-(trifluoromethyl)phenyl]butan-2-one Formula: C11H10F3NO3 MolecularWeight: 261.19721

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H10F3NO3/c1-7(16)10(15(17)18)6-8-4-2-3-5-9(8)11(12,13)14/h2-5,10H,6H2,1H3