1-(3-bromanyl-5-fluoranyl-2-oxidanyl-phenyl)heptan-1-one

Systemtic Name: 1-(3-bromanyl-5-fluoranyl-2-oxidanyl-phenyl)heptan-1-one Openeye Name: 1-(3-bromo-5-fluoro-2-hydroxy-phenyl)heptan-1-one CAS Name: 1-(3-bromo-5-fluoro-2-hydroxyphenyl)-1-heptanone IUPAC Name: 1-(3-bromo-5-fluoro-2-hydroxyphenyl)heptan-1-one Traditional Name: 1-(3-bromo-5-fluoro-2-hydroxy-phenyl)heptan-1-one Formula: C13H16BrFO2 MolecularWeight: 303.167343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=CC(=CC(=C1O)Br)F

Isomeric SMILES

CCCCCCC(=O)C1=CC(=CC(=C1O)Br)F

InChI

InChI=1S/C13H16BrFO2/c1-2-3-4-5-6-12(16)10-7-9(15)8-11(14)13(10)17/h7-8,17H,2-6H2,1H3