5-chloranyl-1-(3-fluoranyl-4-methyl-phenyl)pentan-1-one

Systemtic Name: 5-chloranyl-1-(3-fluoranyl-4-methyl-phenyl)pentan-1-one Openeye Name: 5-chloro-1-(3-fluoro-4-methyl-phenyl)pentan-1-one CAS Name: 5-chloro-1-(3-fluoro-4-methylphenyl)-1-pentanone IUPAC Name: 5-chloro-1-(3-fluoro-4-methylphenyl)pentan-1-one Traditional Name: 5-chloro-1-(3-fluoro-4-methyl-phenyl)pentan-1-one Formula: C12H14ClFO MolecularWeight: 228.690363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCCCCl)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCCCCl)F

InChI

InChI=1S/C12H14ClFO/c1-9-5-6-10(8-11(9)14)12(15)4-2-3-7-13/h5-6,8H,2-4,7H2,1H3