1-[5-bromanyl-2,3,4-tris(oxidanyl)phenyl]pentan-1-one

Systemtic Name: 1-[5-bromanyl-2,3,4-tris(oxidanyl)phenyl]pentan-1-one Openeye Name: 1-(5-bromo-2,3,4-trihydroxy-phenyl)pentan-1-one CAS Name: 1-(5-bromo-2,3,4-trihydroxyphenyl)-1-pentanone IUPAC Name: 1-(5-bromo-2,3,4-trihydroxyphenyl)pentan-1-one Traditional Name: 1-(5-bromo-2,3,4-trihydroxy-phenyl)pentan-1-one Formula: C11H13BrO4 MolecularWeight: 289.12252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrO4/c1-2-3-4-8(13)6-5-7(12)10(15)11(16)9(6)14/h5,14-16H,2-4H2,1H3