1-[3,4-bis(trifluoromethyl)phenyl]-4-chloranyl-butan-1-one

Systemtic Name: 1-[3,4-bis(trifluoromethyl)phenyl]-4-chloranyl-butan-1-one Openeye Name: 1-[3,4-bis(trifluoromethyl)phenyl]-4-chloro-butan-1-one CAS Name: 1-[3,4-bis(trifluoromethyl)phenyl]-4-chloro-1-butanone IUPAC Name: 1-[3,4-bis(trifluoromethyl)phenyl]-4-chlorobutan-1-one Traditional Name: 1-[3,4-bis(trifluoromethyl)phenyl]-4-chloro-butan-1-one Formula: C12H9ClF6O MolecularWeight: 318.642679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CCCCl)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CCCCl)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H9ClF6O/c13-5-1-2-10(20)7-3-4-8(11(14,15)16)9(6-7)12(17,18)19/h3-4,6H,1-2,5H2