1-(5-bromanyl-4-tert-butyl-2-oxidanyl-phenyl)propan-1-one

Systemtic Name: 1-(5-bromanyl-4-tert-butyl-2-oxidanyl-phenyl)propan-1-one Openeye Name: 1-(5-bromo-4-tert-butyl-2-hydroxy-phenyl)propan-1-one CAS Name: 1-(5-bromo-4-tert-butyl-2-hydroxyphenyl)-1-propanone IUPAC Name: 1-(5-bromo-4-tert-butyl-2-hydroxyphenyl)propan-1-one Traditional Name: 1-(5-bromo-4-tert-butyl-2-hydroxy-phenyl)propan-1-one Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1O)C(C)(C)C)Br

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1O)C(C)(C)C)Br

InChI

InChI=1S/C13H17BrO2/c1-5-11(15)8-6-10(14)9(7-12(8)16)13(2,3)4/h6-7,16H,5H2,1-4H3