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

Systemtic Name: 1-(5-bromanyl-2-oxidanyl-phenyl)heptan-1-one Openeye Name: 1-(5-bromo-2-hydroxy-phenyl)heptan-1-one CAS Name: 1-(5-bromo-2-hydroxyphenyl)-1-heptanone IUPAC Name: 1-(5-bromo-2-hydroxyphenyl)heptan-1-one Traditional Name: 1-(5-bromo-2-hydroxy-phenyl)heptan-1-one Formula: C13H17BrO2 MolecularWeight: 285.17688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=C(C=CC(=C1)Br)O

Isomeric SMILES

CCCCCCC(=O)C1=C(C=CC(=C1)Br)O

InChI

InChI=1S/C13H17BrO2/c1-2-3-4-5-6-12(15)11-9-10(14)7-8-13(11)16/h7-9,16H,2-6H2,1H3