1-(3-bromanyl-5-methyl-4-oxidanyl-phenyl)ethanone

Systemtic Name: 1-(3-bromanyl-5-methyl-4-oxidanyl-phenyl)ethanone Openeye Name: 1-(3-bromo-4-hydroxy-5-methyl-phenyl)ethanone CAS Name: 1-(3-bromo-4-hydroxy-5-methylphenyl)ethanone IUPAC Name: 1-(3-bromo-4-hydroxy-5-methylphenyl)ethanone Traditional Name: 1-(3-bromo-4-hydroxy-5-methyl-phenyl)ethanone Formula: C9H9BrO2 MolecularWeight: 229.07056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)C)Br)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)C)Br)O

InChI

InChI=1S/C9H9BrO2/c1-5-3-7(6(2)11)4-8(10)9(5)12/h3-4,12H,1-2H3