(2S)-1-[3,4-bis(oxidanyl)phenyl]-2-bromanyl-pentan-1-one

Systemtic Name: (2S)-1-[3,4-bis(oxidanyl)phenyl]-2-bromanyl-pentan-1-one Openeye Name: (2S)-2-bromo-1-(3,4-dihydroxyphenyl)pentan-1-one CAS Name: (2S)-2-bromo-1-(3,4-dihydroxyphenyl)-1-pentanone IUPAC Name: (2S)-2-bromo-1-(3,4-dihydroxyphenyl)pentan-1-one Traditional Name: (2S)-2-bromo-1-(3,4-dihydroxyphenyl)pentan-1-one Formula: C11H13BrO3 MolecularWeight: 273.12312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@H](C(=O)C1=CC(=C(C=C1)O)O)Br

InChI

InChI=1S/C11H13BrO3/c1-2-3-8(12)11(15)7-4-5-9(13)10(14)6-7/h4-6,8,13-14H,2-3H2,1H3/t8-/m0/s1